methyl 4-[2-[(6-methyl-2-oxidanylidene-1H-pyrimidin-4-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[(6-methyl-2-oxidanylidene-1H-pyrimidin-4-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[(6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 4-[[2-[(6-methyl-2-oxo-1H-pyrimidin-4-yl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[(6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(2-keto-6-methyl-1H-pyrimidin-4-yl)thio]acetyl]amino]benzoic acid methyl ester Formula: C15H15N3O4S MolecularWeight: 333.3623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=O)N1)SCC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC1=CC(=NC(=O)N1)SCC(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C15H15N3O4S/c1-9-7-13(18-15(21)16-9)23-8-12(19)17-11-5-3-10(4-6-11)14(20)22-2/h3-7H,8H2,1-2H3,(H,17,19)(H,16,18,21)