2-[2-[2-(1,3-diphenylpyrazol-4-yl)carbonylhydrazinyl]-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylphenyl)ethanamide

Systemtic Name: 2-[2-[2-(1,3-diphenylpyrazol-4-yl)carbonylhydrazinyl]-2-oxidanylidene-ethyl]sulfanyl-N-(3-methylphenyl)ethanamide Openeye Name: 2-[2-[2-(1,3-diphenylpyrazole-4-carbonyl)hydrazino]-2-oxo-ethyl]sulfanyl-N-(m-tolyl)acetamide CAS Name: 2-[[2-[[(1,3-diphenyl-4-pyrazolyl)-oxomethyl]hydrazo]-2-oxoethyl]thio]-N-(3-methylphenyl)acetamide IUPAC Name: 2-[2-[2-(1,3-diphenylpyrazole-4-carbonyl)hydrazinyl]-2-oxoethyl]sulfanyl-N-(3-methylphenyl)acetamide Traditional Name: 2-[[2-[N'-(1,3-diphenylpyrazole-4-carbonyl)hydrazino]-2-keto-ethyl]thio]-N-(m-tolyl)acetamide Formula: C27H25N5O3S MolecularWeight: 499.5841

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NNC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NNC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H25N5O3S/c1-19-9-8-12-21(15-19)28-24(33)17-36-18-25(34)29-30-27(35)23-16-32(22-13-6-3-7-14-22)31-26(23)20-10-4-2-5-11-20/h2-16H,17-18H2,1H3,(H,28,33)(H,29,34)(H,30,35)