N-[2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylethanoyl]-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-[2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylethanoyl]-1-methyl-pyrrole-2-carboxamide Openeye Name: N-[2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylacetyl]-1-methyl-pyrrole-2-carboxamide CAS Name: N-[2-[[1-(4-methoxyphenyl)-2-benzimidazolyl]thio]-1-oxoethyl]-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-[2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylacetyl]-1-methylpyrrole-2-carboxamide Traditional Name: N-[2-[[1-(4-methoxyphenyl)benzimidazol-2-yl]thio]acetyl]-1-methyl-pyrrole-2-carboxamide Formula: C22H20N4O3S MolecularWeight: 420.4842

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(=O)NC(=O)CSC2=NC3=CC=CC=C3N2C4=CC=C(C=C4)OC

Isomeric SMILES

CN1C=CC=C1C(=O)NC(=O)CSC2=NC3=CC=CC=C3N2C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H20N4O3S/c1-25-13-5-8-19(25)21(28)24-20(27)14-30-22-23-17-6-3-4-7-18(17)26(22)15-9-11-16(29-2)12-10-15/h3-13H,14H2,1-2H3,(H,24,27,28)