1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-ethanone Openeye Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanyl-ethanone CAS Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[1-(4-ethoxyphenyl)-2-benzimidazolyl]thio]ethanone IUPAC Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[1-(4-ethoxyphenyl)benzimidazol-2-yl]sulfanylethanone Traditional Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[(1-p-phenetylbenzimidazol-2-yl)thio]ethanone Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)C4=C(C(=C(N4)C)C(=O)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)C4=C(C(=C(N4)C)C(=O)C)C

InChI

InChI=1S/C25H25N3O3S/c1-5-31-19-12-10-18(11-13-19)28-21-9-7-6-8-20(21)27-25(28)32-14-22(30)24-15(2)23(17(4)29)16(3)26-24/h6-13,26H,5,14H2,1-4H3