Resencatinib

Details

Stereochemistry	MIXED
Molecular Formula	C30H29N7O3
Molecular Weight	535.5964
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC1=NC=C(CN2C3CC2CN(C3)C4=NC=C(C=C4)C5=CC(OC[C@](C)(O)C#C)=CN6N=CC(C#N)=C56)C=C1

InChI

InChIKey=WNPSOODWDSNATA-DPHZAUTASA-N

InChI=1S/C30H29N7O3/c1-4-30(2,38)19-40-25-10-26(29-22(11-31)14-34-37(29)18-25)21-6-7-27(32-13-21)35-16-23-9-24(17-35)36(23)15-20-5-8-28(39-3)33-12-20/h1,5-8,10,12-14,18,23-24,38H,9,15-17,19H2,2-3H3/t23?,24?,30-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C30H29N7O3
Molecular Weight	535.5964
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	1 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 19:55:44 GMT 2023` Edited by `admin` on `Sat Dec 16 19:55:44 GMT 2023`
Record UNII	VW69FG2AYB
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Resencatinib

Official Name

English

Pyrazolo[1,5-a]pyridine-3-carbonitrile, 6-[[(2R)-2-hydroxy-2-methyl-3-butyn-1-yl]oxy]-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]hept-3-yl]-3-pyridinyl]-

Systematic Name

English

6-{[(2R)-2-hydroxy-2-methylbut-3-yn-1-yl]oxy}-4-(6-{6- [(6-methoxypyridin-3-yl)methyl]-3,6- diazabicyclo[3.1.1]heptan-3-yl}pyridin-3- yl)pyrazolo[1,5-a]pyridine-3-carbonitrile

Systematic Name

English

6-[[(2R)-2-Hydroxy-2-methyl-3-butyn-1-yl]oxy]-4-[6-[6-[(6-methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]hept-3-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile

Systematic Name

English

resencatinib [INN]

Common Name

English

Code System Code Type Description

NCI_THESAURUS

C199102