methyl 2-[2-[(2S)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[(2S)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[(1S)-1-methyl-2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[(2S)-1-(4-methylanilino)-1-oxopropan-2-yl]thio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(2S)-1-(4-methylanilino)-1-oxopropan-2-yl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-[[(1S)-2-keto-1-methyl-2-(p-toluidino)ethyl]thio]-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)SC2=NC(=O)C=C(N2)CC(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@H](C)SC2=NC(=O)C=C(N2)CC(=O)OC

InChI

InChI=1S/C17H19N3O4S/c1-10-4-6-12(7-5-10)18-16(23)11(2)25-17-19-13(8-14(21)20-17)9-15(22)24-3/h4-8,11H,9H2,1-3H3,(H,18,23)(H,19,20,21)/t11-/m0/s1