2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)ethanamide

Systemtic Name: 2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)ethanamide Openeye Name: 2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)acetamide CAS Name: 2-[[2-(4-methylanilino)-2-oxoethyl]thio]-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)acetamide IUPAC Name: 2-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-N-(5-oxo-1-phenyl-4H-pyrazol-3-yl)acetamide Traditional Name: N-(5-keto-1-phenyl-2-pyrazolin-3-yl)-2-[[2-keto-2-(p-toluidino)ethyl]thio]acetamide Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=NN(C(=O)C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=NN(C(=O)C2)C3=CC=CC=C3

InChI

InChI=1S/C20H20N4O3S/c1-14-7-9-15(10-8-14)21-18(25)12-28-13-19(26)22-17-11-20(27)24(23-17)16-5-3-2-4-6-16/h2-10H,11-13H2,1H3,(H,21,25)(H,22,23,26)