propyl 2-chloranyl-5-[2-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: propyl 2-chloranyl-5-[2-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: propyl 2-chloro-5-[[2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 2-chloro-5-[[2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]-1-oxoethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 2-chloro-5-[[2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 2-chloro-5-[[2-[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]acetyl]amino]benzoic acid propyl ester Formula: C17H18ClN3O4S MolecularWeight: 395.86052

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(C=CC(=C1)NC(=O)CSC2=NC(=O)C=C(N2)C)Cl

Isomeric SMILES

CCCOC(=O)C1=C(C=CC(=C1)NC(=O)CSC2=NC(=O)C=C(N2)C)Cl

InChI

InChI=1S/C17H18ClN3O4S/c1-3-6-25-16(24)12-8-11(4-5-13(12)18)20-15(23)9-26-17-19-10(2)7-14(22)21-17/h4-5,7-8H,3,6,9H2,1-2H3,(H,20,23)(H,19,21,22)