2-methyl-3-oxidanylidene-4-(phenylcarbonyl)-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)-1H-pyrazole-5-carboxamide

Systemtic Name: 2-methyl-3-oxidanylidene-4-(phenylcarbonyl)-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)-1H-pyrazole-5-carboxamide Openeye Name: 4-benzoyl-2-methyl-3-oxo-N-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)-1H-pyrazole-5-carboxamide CAS Name: 4-benzoyl-2-methyl-3-oxo-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)-1H-pyrazole-5-carboxamide IUPAC Name: 4-benzoyl-2-methyl-3-oxo-N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)-1H-pyrazole-5-carboxamide Traditional Name: 4-benzoyl-5-keto-1-methyl-N-(2-thioxo-3H-1,3,4-thiadiazol-5-yl)-3-pyrazoline-3-carboxamide Formula: C14H11N5O3S2 MolecularWeight: 361.39884

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=C(N1)C(=O)NC2=NNC(=S)S2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CN1C(=O)C(=C(N1)C(=O)NC2=NNC(=S)S2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C14H11N5O3S2/c1-19-12(22)8(10(20)7-5-3-2-4-6-7)9(18-19)11(21)15-13-16-17-14(23)24-13/h2-6,18H,1H3,(H,17,23)(H,15,16,21)