(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl) (E)-N-[(6-methyl-5-oxidanylidene-2H-1,2,4-triazin-3-yl)amino]benzenecarboximidothioate

Systemtic Name: (6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl) (E)-N-[(6-methyl-5-oxidanylidene-2H-1,2,4-triazin-3-yl)amino]benzenecarboximidothioate Openeye Name: (6-methyl-4-oxo-1H-pyrimidin-2-yl) (E)-N-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)amino]benzenecarboximidothioate CAS Name: (E)-N-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)amino]benzenecarboximidothioic acid (6-methyl-4-oxo-1H-pyrimidin-2-yl) ester IUPAC Name: (6-methyl-4-oxo-1H-pyrimidin-2-yl) (E)-N-[(6-methyl-5-oxo-2H-1,2,4-triazin-3-yl)amino]benzenecarboximidothioate Traditional Name: (E)-N-[(5-keto-6-methyl-2H-1,2,4-triazin-3-yl)amino]benzenecarboximidothioic acid (4-keto-6-methyl-1H-pyrimidin-2-yl) ester Formula: C16H15N7O2S MolecularWeight: 369.401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SC(=NNC2=NC(=O)C(=NN2)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=O)N=C(N1)S/C(=N/NC2=NC(=O)C(=NN2)C)/C3=CC=CC=C3

InChI

InChI=1S/C16H15N7O2S/c1-9-8-12(24)18-16(17-9)26-14(11-6-4-3-5-7-11)21-23-15-19-13(25)10(2)20-22-15/h3-8H,1-2H3,(H,17,18,24)(H2,19,22,23,25)/b21-14+