ethyl 5-[2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylethanoyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-[[1-(4-methoxyphenyl)-2-benzimidazolyl]thio]-1-oxoethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylacetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-[[1-(4-methoxyphenyl)benzimidazol-2-yl]thio]acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C25H25N3O4S MolecularWeight: 463.5487

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C)C(=O)CSC2=NC3=CC=CC=C3N2C4=CC=C(C=C4)OC)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C)C(=O)CSC2=NC3=CC=CC=C3N2C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C25H25N3O4S/c1-5-32-24(30)22-15(2)23(26-16(22)3)21(29)14-33-25-27-19-8-6-7-9-20(19)28(25)17-10-12-18(31-4)13-11-17/h6-13,26H,5,14H2,1-4H3