3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)propanamide

Systemtic Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)propanamide Openeye Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)propanamide CAS Name: 3-[(4,6-dimethyl-2-pyrimidinyl)thio]-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)propanamide IUPAC Name: 3-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)propanamide Traditional Name: 3-[(4,6-dimethylpyrimidin-2-yl)thio]-N-(5-keto-1-phenyl-3-pyrazolin-3-yl)propionamide Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCCC(=O)NC2=CC(=O)N(N2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCCC(=O)NC2=CC(=O)N(N2)C3=CC=CC=C3)C

InChI

InChI=1S/C18H19N5O2S/c1-12-10-13(2)20-18(19-12)26-9-8-16(24)21-15-11-17(25)23(22-15)14-6-4-3-5-7-14/h3-7,10-11,22H,8-9H2,1-2H3,(H,21,24)