methyl 2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]propanoate

Systemtic Name: methyl 2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]propanoate Openeye Name: methyl 2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]propanoate CAS Name: 2-[(4-oxo-1H-quinazolin-2-yl)thio]propanoic acid methyl ester IUPAC Name: methyl 2-[(4-oxo-1H-quinazolin-2-yl)sulfanyl]propanoate Traditional Name: 2-[(4-keto-1H-quinazolin-2-yl)thio]propionic acid methyl ester Formula: C12H12N2O3S MolecularWeight: 264.30028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)SC1=NC(=O)C2=CC=CC=C2N1

Isomeric SMILES

CC(C(=O)OC)SC1=NC(=O)C2=CC=CC=C2N1

InChI

InChI=1S/C12H12N2O3S/c1-7(11(16)17-2)18-12-13-9-6-4-3-5-8(9)10(15)14-12/h3-7H,1-2H3,(H,13,14,15)