1,3-dimethyl-4-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2,6-bis(oxidanylidene)pyrimidine-5-carbonitrile

Systemtic Name: 1,3-dimethyl-4-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2,6-bis(oxidanylidene)pyrimidine-5-carbonitrile Openeye Name: 1,3-dimethyl-4-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2,6-dioxo-pyrimidine-5-carbonitrile CAS Name: 1,3-dimethyl-4-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]-2,6-dioxo-5-pyrimidinecarbonitrile IUPAC Name: 1,3-dimethyl-4-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-2,6-dioxopyrimidine-5-carbonitrile Traditional Name: 2,4-diketo-1,3-dimethyl-6-[(4-methyl-5-phenyl-1,2,4-triazol-3-yl)thio]pyrimidine-5-carbonitrile Formula: C16H14N6O2S MolecularWeight: 354.38636

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N(C1=O)C)C#N)SC2=NN=C(N2C)C3=CC=CC=C3

Isomeric SMILES

CN1C(=C(C(=O)N(C1=O)C)C#N)SC2=NN=C(N2C)C3=CC=CC=C3

InChI

InChI=1S/C16H14N6O2S/c1-20-12(10-7-5-4-6-8-10)18-19-15(20)25-14-11(9-17)13(23)21(2)16(24)22(14)3/h4-8H,1-3H3