N-(3-cyano-1-cyclopentyl-4,5-dimethyl-pyrrol-2-yl)-2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(3-cyano-1-cyclopentyl-4,5-dimethyl-pyrrol-2-yl)-2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(3-cyano-1-cyclopentyl-4,5-dimethyl-pyrrol-2-yl)-2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(3-cyano-1-cyclopentyl-4,5-dimethyl-2-pyrrolyl)-2-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(3-cyano-1-cyclopentyl-4,5-dimethylpyrrol-2-yl)-2-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(3-cyano-1-cyclopentyl-4,5-dimethyl-pyrrol-2-yl)-2-[4-(3,4-dimethylphenyl)sulfonylpiperazino]acetamide Formula: C26H35N5O3S MolecularWeight: 497.6528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=C(C(=C(N3C4CCCC4)C)C)C#N)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=C(C(=C(N3C4CCCC4)C)C)C#N)C

InChI

InChI=1S/C26H35N5O3S/c1-18-9-10-23(15-19(18)2)35(33,34)30-13-11-29(12-14-30)17-25(32)28-26-24(16-27)20(3)21(4)31(26)22-7-5-6-8-22/h9-10,15,22H,5-8,11-14,17H2,1-4H3,(H,28,32)