N-[[4,5-dimethyl-1-(phenylmethyl)-2-pyrrol-1-yl-pyrrol-3-yl]methyl]thiophene-2-carboxamide

Systemtic Name: N-[[4,5-dimethyl-1-(phenylmethyl)-2-pyrrol-1-yl-pyrrol-3-yl]methyl]thiophene-2-carboxamide Openeye Name: N-[(1-benzyl-4,5-dimethyl-2-pyrrol-1-yl-pyrrol-3-yl)methyl]thiophene-2-carboxamide CAS Name: N-[[4,5-dimethyl-1-(phenylmethyl)-2-(1-pyrrolyl)-3-pyrrolyl]methyl]-2-thiophenecarboxamide IUPAC Name: N-[(1-benzyl-4,5-dimethyl-2-pyrrol-1-ylpyrrol-3-yl)methyl]thiophene-2-carboxamide Traditional Name: N-[(1-benzyl-4,5-dimethyl-2-pyrrol-1-yl-pyrrol-3-yl)methyl]thiophene-2-carboxamide Formula: C23H23N3OS MolecularWeight: 389.51322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1CNC(=O)C2=CC=CS2)N3C=CC=C3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(N(C(=C1CNC(=O)C2=CC=CS2)N3C=CC=C3)CC4=CC=CC=C4)C

InChI

InChI=1S/C23H23N3OS/c1-17-18(2)26(16-19-9-4-3-5-10-19)23(25-12-6-7-13-25)20(17)15-24-22(27)21-11-8-14-28-21/h3-14H,15-16H2,1-2H3,(H,24,27)