(5Z)-1-methyl-5-[[(4S)-3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione

Systemtic Name: (5Z)-1-methyl-5-[[(4S)-3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Openeye Name: (5Z)-1-methyl-5-[[(4S)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione CAS Name: (5Z)-1-methyl-5-[[(4S)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione IUPAC Name: (5Z)-1-methyl-5-[[(4S)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Traditional Name: (5Z)-5-[[(4S)-5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl]methylene]-1-methyl-2-thioxo-hexahydropyrimidine-4,6-quinone Formula: C16H14N4O3S MolecularWeight: 342.37236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1C=C2C(=O)NC(=S)N(C2=O)C)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=O)[C@H]1/C=C\2/C(=O)NC(=S)N(C2=O)C)C3=CC=CC=C3

InChI

InChI=1S/C16H14N4O3S/c1-9-11(8-12-13(21)17-16(24)19(2)14(12)22)15(23)20(18-9)10-6-4-3-5-7-10/h3-8,11H,1-2H3,(H,17,21,24)/b12-8-/t11-/m0/s1