methyl 2,4-dimethyl-6-[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: methyl 2,4-dimethyl-6-[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: methyl 2,4-dimethyl-6-[2-oxo-2-[2-(p-tolylsulfanyl)ethylamino]ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 2,4-dimethyl-6-[[2-[2-[(4-methylphenyl)thio]ethylamino]-2-oxoethyl]thio]-5-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2,4-dimethyl-6-[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxoethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-[[2-keto-2-[2-(p-tolylthio)ethylamino]ethyl]thio]-2,6-dimethyl-pyrimidine-5-carboxylic acid methyl ester Formula: C19H23N3O3S2 MolecularWeight: 405.53422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)CSC2=NC(=NC(=C2C(=O)OC)C)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)CSC2=NC(=NC(=C2C(=O)OC)C)C

InChI

InChI=1S/C19H23N3O3S2/c1-12-5-7-15(8-6-12)26-10-9-20-16(23)11-27-18-17(19(24)25-4)13(2)21-14(3)22-18/h5-8H,9-11H2,1-4H3,(H,20,23)