ZAFIRLUKAST DECYCLOPENTYL METHYL ESTER

Details

Stereochemistry	ACHIRAL
Molecular Formula	C27H27N3O6S
Molecular Weight	521.585
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ZAFIRLUKAST DECYCLOPENTYL METHYL ESTER

Structure Search

SMILES

COC(=O)NC1=CC=C2N(C)C=C(CC3=CC=C(C=C3OC)C(=O)NS(=O)(=O)C4=CC=CC=C4C)C2=C1

InChI

InChIKey=URZMDHMOLIPBIX-UHFFFAOYSA-N

InChI=1S/C27H27N3O6S/c1-17-7-5-6-8-25(17)37(33,34)29-26(31)19-10-9-18(24(14-19)35-3)13-20-16-30(2)23-12-11-21(15-22(20)23)28-27(32)36-4/h5-12,14-16H,13H2,1-4H3,(H,28,32)(H,29,31)

HIDE SMILES / InChI

Molecular Formula	C27H27N3O6S
Molecular Weight	521.585
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 11:50:11 GMT 2023` Edited by `admin` on `Sat Dec 16 11:50:11 GMT 2023`
Record UNII	GQ3J3C7QAE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ZAFIRLUKAST DECYCLOPENTYL METHYL ESTER

Common Name

English

CARBAMIC ACID, N-(3-((2-METHOXY-4-((((2-METHYLPHENYL)SULFONYL)AMINO)CARBONYL)PHENYL)METHYL)-1-METHYL-1H-INDOL-5-YL)-, METHYL ESTER

Systematic Name

English

METHYL N-(3-((2-METHOXY-4-((((2-METHYLPHENYL)SULFONYL)AMINO)CARBONYL)PHENYL)METHYL)-1-METHYL-1H-INDOL-5-YL)CARBAMATE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID30655289

Created by admin on Sat Dec 16 11:50:11 GMT 2023 , Edited by admin on Sat Dec 16 11:50:11 GMT 2023

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FDA UNII

GQ3J3C7QAE

Created by admin on Sat Dec 16 11:50:11 GMT 2023 , Edited by admin on Sat Dec 16 11:50:11 GMT 2023

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PUBCHEM

42633298

Created by admin on Sat Dec 16 11:50:11 GMT 2023 , Edited by admin on Sat Dec 16 11:50:11 GMT 2023

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CAS

1159195-67-1

Created by admin on Sat Dec 16 11:50:11 GMT 2023 , Edited by admin on Sat Dec 16 11:50:11 GMT 2023

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