methyl 2-[2-[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[2-(o-tolylmethylamino)-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[2-[(2-methylphenyl)methylamino]-2-oxoethyl]thio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[4-keto-2-[[2-keto-2-[(2-methylbenzyl)amino]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=CC=C1CNC(=O)CSC2=NC(=O)C=C(N2)CC(=O)OC

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)CSC2=NC(=O)C=C(N2)CC(=O)OC

InChI

InChI=1S/C17H19N3O4S/c1-11-5-3-4-6-12(11)9-18-15(22)10-25-17-19-13(7-14(21)20-17)8-16(23)24-2/h3-7H,8-10H2,1-2H3,(H,18,22)(H,19,20,21)