N-[4-(cyanomethyl)phenyl]-3-(1-propyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)propanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-3-(1-propyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)propanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-3-(1-propyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)propanamide CAS Name: N-[4-(cyanomethyl)phenyl]-3-[1-propyl-5-(1-pyrrolidinylsulfonyl)-2-benzimidazolyl]propanamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-3-(1-propyl-5-pyrrolidin-1-ylsulfonylbenzimidazol-2-yl)propanamide Traditional Name: N-[4-(cyanomethyl)phenyl]-3-(1-propyl-5-pyrrolidinosulfonyl-benzimidazol-2-yl)propionamide Formula: C25H29N5O3S MolecularWeight: 479.59446

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1CCC(=O)NC4=CC=C(C=C4)CC#N

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1CCC(=O)NC4=CC=C(C=C4)CC#N

InChI

InChI=1S/C25H29N5O3S/c1-2-15-30-23-10-9-21(34(32,33)29-16-3-4-17-29)18-22(23)28-24(30)11-12-25(31)27-20-7-5-19(6-8-20)13-14-26/h5-10,18H,2-4,11-13,15-17H2,1H3,(H,27,31)