3-methyl-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-oxidanylidene-pyrimidin-4-olate

Systemtic Name: 3-methyl-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 3-methyl-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-6-oxo-pyrimidin-4-olate CAS Name: 3-methyl-2-[[2-(4-methylanilino)-2-oxoethyl]thio]-6-oxo-4-pyrimidinolate IUPAC Name: 3-methyl-2-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-6-oxopyrimidin-4-olate Traditional Name: 6-keto-2-[[2-keto-2-(p-toluidino)ethyl]thio]-3-methyl-pyrimidin-4-olate Formula: C14H14N3O3S- MolecularWeight: 304.34426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C=C(N2C)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C=C(N2C)[O-]

InChI

InChI=1S/C14H15N3O3S/c1-9-3-5-10(6-4-9)15-12(19)8-21-14-16-11(18)7-13(20)17(14)2/h3-7,20H,8H2,1-2H3,(H,15,19)/p-1