N,3-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-(phenylmethyl)-6-(propanoylamino)benzimidazole-4-carboxamide

Systemtic Name: N,3-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-2-(phenylmethyl)-6-(propanoylamino)benzimidazole-4-carboxamide Openeye Name: 2-benzyl-N,3-dimethyl-N-[(2-methylthiazol-4-yl)methyl]-6-(propanoylamino)benzimidazole-4-carboxamide CAS Name: N,3-dimethyl-N-[(2-methyl-4-thiazolyl)methyl]-6-(1-oxopropylamino)-2-(phenylmethyl)-4-benzimidazolecarboxamide IUPAC Name: 2-benzyl-N,3-dimethyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-6-(propanoylamino)benzimidazole-4-carboxamide Traditional Name: 2-benzyl-N,3-dimethyl-N-[(2-methylthiazol-4-yl)methyl]-6-propionamido-benzimidazole-4-carboxamide Formula: C25H27N5O2S MolecularWeight: 461.57918

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC2=C(C(=C1)C(=O)N(C)CC3=CSC(=N3)C)N(C(=N2)CC4=CC=CC=C4)C

Isomeric SMILES

CCC(=O)NC1=CC2=C(C(=C1)C(=O)N(C)CC3=CSC(=N3)C)N(C(=N2)CC4=CC=CC=C4)C

InChI

InChI=1S/C25H27N5O2S/c1-5-23(31)27-18-12-20(25(32)29(3)14-19-15-33-16(2)26-19)24-21(13-18)28-22(30(24)4)11-17-9-7-6-8-10-17/h6-10,12-13,15H,5,11,14H2,1-4H3,(H,27,31)