Nurandociguat

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C30H36ClF2N5O2
Molecular Weight	572.089
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)CN1CCN(CC1)C2=CC=C(C=C2)C3=CC=C(Cl)C=C3N4CCC[C@H](C4)N5N=CC(C(O)=O)=C5C(F)F

InChI

InChIKey=KNGOFJLMZYHAGD-XMMPIXPASA-N

InChI=1S/C30H36ClF2N5O2/c1-20(2)18-35-12-14-36(15-13-35)23-8-5-21(6-9-23)25-10-7-22(31)16-27(25)37-11-3-4-24(19-37)38-28(29(32)33)26(17-34-38)30(39)40/h5-10,16-17,20,24,29H,3-4,11-15,18-19H2,1-2H3,(H,39,40)/t24-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C30H36ClF2N5O2
Molecular Weight	572.089
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 18:41:10 GMT 2025` Edited by `admin` on `Wed Apr 02 18:41:10 GMT 2025`
Record UNII	LPU8429UK5
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

nurandociguat [INN]

Preferred Name

English

Nurandociguat

Official Name

English

1H-Pyrazole-4-carboxylic acid, 1-[(3R)-1-[4-chloro-4?-[4-(2-methylpropyl)-1-piperazinyl][1,1?-biphenyl]-2-yl]-3-piperidinyl]-5-(difluoromethyl)-

Systematic Name

English

1-[(3R)-1-[4-Chloro-4?-[4-(2-methylpropyl)-1-piperazinyl][1,1?-biphenyl]-2-yl]-3-piperidinyl]-5-(difluoromethyl)-1H-pyrazole-4-carboxylic acid

Systematic Name

English

1-[(3R)-1-{4-Chloro-4'-[4-(2-methylpropyl)piperazin-1-yl][1,1'-biphenyl]-2-yl}piperidin-3-yl]-5-(difluoromethyl)-1H-pyrazole-4-carboxylic acid

Systematic Name

English

Code System Code Type Description

SMS_ID

300000054570