methyl 2-[6-azanyl-1-(3-methylphenyl)-4-oxidanylidene-pyrimidin-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[6-azanyl-1-(3-methylphenyl)-4-oxidanylidene-pyrimidin-2-yl]sulfanylethanoate Openeye Name: methyl 2-[6-amino-1-(m-tolyl)-4-oxo-pyrimidin-2-yl]sulfanylacetate CAS Name: 2-[[6-amino-1-(3-methylphenyl)-4-oxo-2-pyrimidinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[6-amino-1-(3-methylphenyl)-4-oxopyrimidin-2-yl]sulfanylacetate Traditional Name: 2-[[6-amino-4-keto-1-(m-tolyl)pyrimidin-2-yl]thio]acetic acid methyl ester Formula: C14H15N3O3S MolecularWeight: 305.3522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=CC(=O)N=C2SCC(=O)OC)N

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=CC(=O)N=C2SCC(=O)OC)N

InChI

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