3-(2,6-Difluoro-3,5-dimethoxyphenyl)-1-ethyl-8-[(morpholin-4-yl)methyl]-7-(phenylsulfonyl)-1,3,4,7-tetrahydro-2H-pyrrolo[3′,2′:5,6]pyrido[4,3-d]pyrimidin-2-one

Details

Stereochemistry	ACHIRAL
Molecular Formula	C30H31F2N5O6S
Molecular Weight	627.659
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-(2,6-Difluoro-3,5-dimethoxyphenyl)-1-ethyl-8-[(morpholin-4-yl)methyl]-7-(phenylsulfonyl)-1,3,4,7-tetrahydro-2H-pyrrolo[3′,2′:5,6]pyrido[4,3-d]pyrimidin-2-one

Structure Search

SMILES

CCN1C(=O)N(CC2=C1C3=C(N=C2)N(C(CN4CCOCC4)=C3)S(=O)(=O)C5=CC=CC=C5)C6=C(F)C(OC)=CC(OC)=C6F

InChI

InChIKey=KYNRTBVNGQTQFZ-UHFFFAOYSA-N

InChI=1S/C30H31F2N5O6S/c1-4-35-27-19(17-36(30(35)38)28-25(31)23(41-2)15-24(42-3)26(28)32)16-33-29-22(27)14-20(18-34-10-12-43-13-11-34)37(29)44(39,40)21-8-6-5-7-9-21/h5-9,14-16H,4,10-13,17-18H2,1-3H3

HIDE SMILES / InChI

Molecular Formula	C30H31F2N5O6S
Molecular Weight	627.659
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 20:20:46 GMT 2023` Edited by `admin` on `Sat Dec 16 20:20:46 GMT 2023`
Record UNII	298BQ7BH6P
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-(2,6-Difluoro-3,5-dimethoxyphenyl)-1-ethyl-8-[(morpholin-4-yl)methyl]-7-(phenylsulfonyl)-1,3,4,7-tetrahydro-2H-pyrrolo[3′,2′:5,6]pyrido[4,3-d]pyrimidin-2-one

Systematic Name

English

3-(2,6-Difluoro-3,5-dimethoxyphenyl)-1-ethyl-1,3,4,7-tetrahydro-8-(4-morpholinylmethyl)-7-(phenylsulfonyl)-2H-pyrrolo[3′,2′:5,6]pyrido[4,3-d]pyrimidin-2-one

Systematic Name

English

2H-Pyrrolo[3′,2′:5,6]pyrido[4,3-d]pyrimidin-2-one, 3-(2,6-difluoro-3,5-dimethoxyphenyl)-1-ethyl-1,3,4,7-tetrahydro-8-(4-morpholinylmethyl)-7-(phenylsulfonyl)-

Systematic Name

English

Code System Code Type Description

CAS

1513860-02-0

Created by admin on Sat Dec 16 20:20:46 GMT 2023 , Edited by admin on Sat Dec 16 20:20:46 GMT 2023

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PUBCHEM

86705694

Created by admin on Sat Dec 16 20:20:46 GMT 2023 , Edited by admin on Sat Dec 16 20:20:46 GMT 2023

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FDA UNII

298BQ7BH6P

Created by admin on Sat Dec 16 20:20:46 GMT 2023 , Edited by admin on Sat Dec 16 20:20:46 GMT 2023

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