JNJ-10329670

Details

Stereochemistry	ACHIRAL
Molecular Formula	C30H34ClF3N6O3S
Molecular Weight	651.143
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

SMILES

CN1C(=O)N(C2CCN(CCCN3N=C(C4=C3CCN(C4)S(C)(=O)=O)C5=CC=C(C=C5)C(F)(F)F)CC2)C6=C1C=CC(Cl)=C6

InChI

InChIKey=NVAHQQYCEWEDKM-UHFFFAOYSA-N

InChI=1S/C30H34ClF3N6O3S/c1-36-26-9-8-22(31)18-27(26)40(29(36)41)23-10-15-37(16-11-23)13-3-14-39-25-12-17-38(44(2,42)43)19-24(25)28(35-39)20-4-6-21(7-5-20)30(32,33)34/h4-9,18,23H,3,10-17,19H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C30H34ClF3N6O3S
Molecular Weight	651.143
Charge	0
Count	MOL RATIO 1 MOL RATIO (average)

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

Approval Year

PubMed

PubMed

Show entries

Title	Date	PubMed
Identification of a potent and selective noncovalent cathepsin S inhibitor.	2004 Jan	14566006
Discovery and SAR studies of a novel series of noncovalent cathepsin S inhibitors.	2005 Mar 15	15745822

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Substance Class	Chemical
Record UNII	2HVJ5O3FV3
Record Status	`Validated (UNII)`
Record Version

Show entries

Name

Type

Language

JNJ-10329670

Common Name

English

1H-PYRAZOLO(4,3-C)PYRIDINE, 1-(3-(4-(6-CHLORO-2,3-DIHYDRO-3-METHYL-2-OXO-1H-BENZIMIDAZOL-1-YL)-1-PIPERIDINYL)PROPYL)-4,5,6,7-TETRAHYDRO-5-(METHYLSULFONYL)-3-(4-(TRIFLUOROMETHYL)PHENYL)-

Preferred Name

English

2H-BENZIMIDAZOL-2-ONE, 5-CHLORO-1,3-DIHYDRO-1-METHYL-3-(1-(3-(4,5,6,7-TETRAHYDRO-5-(METHYLSULFONYL)-3-(4-(TRIFLUOROMETHYL)PHENYL)-1H-PYRAZOLO(4,3-C)PYRIDIN-1-YL)PROPYL)-4-PIPERIDINYL)-

Systematic Name

English

5-CHLORO-3-(1-(3-(5-METHANESULFONYL-3-(4-TRIFLUOROMETHYLPHENYL)-4,5,6,7-TETRAHYDROPYRAZOLO(4,3-C)PYRIDIN-1-YL)PROPYL)PIPERIDIN-4-YL)-1-METHYL-1,3-DIHYDROBENZIMIDAZOL-2-ONE

Systematic Name

English

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Code System

Code

Type

Description

FDA UNII

2HVJ5O3FV3

PRIMARY