(phenylmethyl) 4-(6-cyano-1H-benzimidazol-2-yl)-4-piperazin-1-yl-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-(6-cyano-1H-benzimidazol-2-yl)-4-piperazin-1-yl-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: benzyl 4-(6-cyano-1H-benzimidazol-2-yl)-4-piperazin-1-yl-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-(6-cyano-1H-benzimidazol-2-yl)-2-[oxo(3-thiazolidinyl)methyl]-4-(1-piperazinyl)-1-pyrrolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(6-cyano-1H-benzimidazol-2-yl)-4-piperazin-1-yl-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-(6-cyano-1H-benzimidazol-2-yl)-4-piperazino-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid benzyl ester Formula: C28H31N7O3S MolecularWeight: 545.65584

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2(CC(N(C2)C(=O)OCC3=CC=CC=C3)C(=O)N4CCSC4)C5=NC6=C(N5)C=C(C=C6)C#N

Isomeric SMILES

C1CN(CCN1)C2(CC(N(C2)C(=O)OCC3=CC=CC=C3)C(=O)N4CCSC4)C5=NC6=C(N5)C=C(C=C6)C#N

InChI

InChI=1S/C28H31N7O3S/c29-16-21-6-7-22-23(14-21)32-26(31-22)28(34-10-8-30-9-11-34)15-24(25(36)33-12-13-39-19-33)35(18-28)27(37)38-17-20-4-2-1-3-5-20/h1-7,14,24,30H,8-13,15,17-19H2,(H,31,32)