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

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]ethanamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]acetamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-[methyl-[[4-(methylthio)phenyl]methyl]amino]acetamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-[methyl-[(4-methylsulfanylphenyl)methyl]amino]acetamide Traditional Name: N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2-[methyl-[4-(methylthio)benzyl]amino]acetamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CN(C)CC3=CC=C(C=C3)SC

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)CN(C)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C22H26N4O2S/c1-16-21(22(28)26(25(16)3)18-8-6-5-7-9-18)23-20(27)15-24(2)14-17-10-12-19(29-4)13-11-17/h5-13H,14-15H2,1-4H3,(H,23,27)