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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=NC(=O)N2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=CC=NC(=O)N2

InChI

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