N-(cyanomethyl)-4-methyl-1-(1-methyl-5-piperazin-1-yl-benzimidazol-2-yl)pyrrolidine-2-carboxamide

Systemtic Name: N-(cyanomethyl)-4-methyl-1-(1-methyl-5-piperazin-1-yl-benzimidazol-2-yl)pyrrolidine-2-carboxamide Openeye Name: N-(cyanomethyl)-4-methyl-1-(1-methyl-5-piperazin-1-yl-benzimidazol-2-yl)pyrrolidine-2-carboxamide CAS Name: N-(cyanomethyl)-4-methyl-1-[1-methyl-5-(1-piperazinyl)-2-benzimidazolyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(cyanomethyl)-4-methyl-1-(1-methyl-5-piperazin-1-ylbenzimidazol-2-yl)pyrrolidine-2-carboxamide Traditional Name: N-(cyanomethyl)-4-methyl-1-(1-methyl-5-piperazino-benzimidazol-2-yl)pyrrolidine-2-carboxamide Formula: C20H27N7O MolecularWeight: 381.47468

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(N(C1)C2=NC3=C(N2C)C=CC(=C3)N4CCNCC4)C(=O)NCC#N

Isomeric SMILES

CC1CC(N(C1)C2=NC3=C(N2C)C=CC(=C3)N4CCNCC4)C(=O)NCC#N

InChI

InChI=1S/C20H27N7O/c1-14-11-18(19(28)23-6-5-21)27(13-14)20-24-16-12-15(3-4-17(16)25(20)2)26-9-7-22-8-10-26/h3-4,12,14,18,22H,6-11,13H2,1-2H3,(H,23,28)