N-[2,5-dimethyl-3-[2-(1-methylbenzimidazol-2-yl)sulfanylethanoyl]pyrrol-1-yl]benzamide

Systemtic Name: N-[2,5-dimethyl-3-[2-(1-methylbenzimidazol-2-yl)sulfanylethanoyl]pyrrol-1-yl]benzamide Openeye Name: N-[2,5-dimethyl-3-[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]pyrrol-1-yl]benzamide CAS Name: N-[2,5-dimethyl-3-[2-[(1-methyl-2-benzimidazolyl)thio]-1-oxoethyl]-1-pyrrolyl]benzamide IUPAC Name: N-[2,5-dimethyl-3-[2-(1-methylbenzimidazol-2-yl)sulfanylacetyl]pyrrol-1-yl]benzamide Traditional Name: N-[2,5-dimethyl-3-[2-[(1-methylbenzimidazol-2-yl)thio]acetyl]pyrrol-1-yl]benzamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1NC(=O)C2=CC=CC=C2)C)C(=O)CSC3=NC4=CC=CC=C4N3C

Isomeric SMILES

CC1=CC(=C(N1NC(=O)C2=CC=CC=C2)C)C(=O)CSC3=NC4=CC=CC=C4N3C

InChI

InChI=1S/C23H22N4O2S/c1-15-13-18(16(2)27(15)25-22(29)17-9-5-4-6-10-17)21(28)14-30-23-24-19-11-7-8-12-20(19)26(23)3/h4-13H,14H2,1-3H3,(H,25,29)