N-(4-chloranyl-2-methyl-phenyl)-2-[2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide

Systemtic Name: N-(4-chloranyl-2-methyl-phenyl)-2-[2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-ethanamide Openeye Name: N-(4-chloro-2-methyl-phenyl)-2-[2-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-2-oxo-ethyl]sulfanyl-acetamide CAS Name: N-(4-chloro-2-methylphenyl)-2-[[2-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-2-oxoethyl]thio]acetamide IUPAC Name: N-(4-chloro-2-methylphenyl)-2-[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoethyl]sulfanylacetamide Traditional Name: N-(4-chloro-2-methyl-phenyl)-2-[[2-keto-2-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]ethyl]thio]acetamide Formula: C22H23ClN4O3S MolecularWeight: 458.96102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23ClN4O3S/c1-14-11-16(23)9-10-18(14)24-19(28)12-31-13-20(29)25-21-15(2)26(3)27(22(21)30)17-7-5-4-6-8-17/h4-11H,12-13H2,1-3H3,(H,24,28)(H,25,29)