methyl 1-[1-[[4-[(2-butyl-4-methyl-benzimidazol-1-yl)methyl]phenyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]pyrrole-2-carboxylate

Systemtic Name: methyl 1-[1-[[4-[(2-butyl-4-methyl-benzimidazol-1-yl)methyl]phenyl]amino]-1-oxidanylidene-3-phenyl-propan-2-yl]pyrrole-2-carboxylate Openeye Name: methyl 1-[1-benzyl-2-[4-[(2-butyl-4-methyl-benzimidazol-1-yl)methyl]anilino]-2-oxo-ethyl]pyrrole-2-carboxylate CAS Name: 1-[1-[4-[(2-butyl-4-methyl-1-benzimidazolyl)methyl]anilino]-1-oxo-3-phenylpropan-2-yl]-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-[1-[4-[(2-butyl-4-methylbenzimidazol-1-yl)methyl]anilino]-1-oxo-3-phenylpropan-2-yl]pyrrole-2-carboxylate Traditional Name: 1-[1-benzyl-2-[4-[(2-butyl-4-methyl-benzimidazol-1-yl)methyl]anilino]-2-keto-ethyl]pyrrole-2-carboxylic acid methyl ester Formula: C34H36N4O3 MolecularWeight: 548.67464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=CC=C2N1CC3=CC=C(C=C3)NC(=O)C(CC4=CC=CC=C4)N5C=CC=C5C(=O)OC)C

Isomeric SMILES

CCCCC1=NC2=C(C=CC=C2N1CC3=CC=C(C=C3)NC(=O)C(CC4=CC=CC=C4)N5C=CC=C5C(=O)OC)C

InChI

InChI=1S/C34H36N4O3/c1-4-5-16-31-36-32-24(2)11-9-14-28(32)38(31)23-26-17-19-27(20-18-26)35-33(39)30(22-25-12-7-6-8-13-25)37-21-10-15-29(37)34(40)41-3/h6-15,17-21,30H,4-5,16,22-23H2,1-3H3,(H,35,39)