N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanyl-acetamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-[[1-(4-methoxyphenyl)-2-benzimidazolyl]thio]acetamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[1-(4-methoxyphenyl)benzimidazol-2-yl]sulfanylacetamide Traditional Name: N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-[[1-(4-methoxyphenyl)benzimidazol-2-yl]thio]acetamide Formula: C27H25N5O3S MolecularWeight: 499.5841

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSC3=NC4=CC=CC=C4N3C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CSC3=NC4=CC=CC=C4N3C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H25N5O3S/c1-18-25(26(34)32(30(18)2)20-9-5-4-6-10-20)29-24(33)17-36-27-28-22-11-7-8-12-23(22)31(27)19-13-15-21(35-3)16-14-19/h4-16H,17H2,1-3H3,(H,29,33)