5-methyl-3-oxidanylidene-N-phenyl-4-pyrimidin-2-ylsulfanyl-1H-pyrazole-2-carboxamide

Systemtic Name: 5-methyl-3-oxidanylidene-N-phenyl-4-pyrimidin-2-ylsulfanyl-1H-pyrazole-2-carboxamide Openeye Name: 5-methyl-3-oxo-N-phenyl-4-pyrimidin-2-ylsulfanyl-1H-pyrazole-2-carboxamide CAS Name: 5-methyl-3-oxo-N-phenyl-4-(2-pyrimidinylthio)-1H-pyrazole-2-carboxamide IUPAC Name: 5-methyl-3-oxo-N-phenyl-4-pyrimidin-2-ylsulfanyl-1H-pyrazole-2-carboxamide Traditional Name: 5-keto-3-methyl-N-phenyl-4-(2-pyrimidylthio)-3-pyrazoline-1-carboxamide Formula: C15H13N5O2S MolecularWeight: 327.36102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C(=O)NC2=CC=CC=C2)SC3=NC=CC=N3

Isomeric SMILES

CC1=C(C(=O)N(N1)C(=O)NC2=CC=CC=C2)SC3=NC=CC=N3

InChI

InChI=1S/C15H13N5O2S/c1-10-12(23-14-16-8-5-9-17-14)13(21)20(19-10)15(22)18-11-6-3-2-4-7-11/h2-9,19H,1H3,(H,18,22)