methyl (E)-3-(6-methylsulfanyl-4-oxidanylidene-quinazolin-3-yl)prop-2-enoate

Systemtic Name: methyl (E)-3-(6-methylsulfanyl-4-oxidanylidene-quinazolin-3-yl)prop-2-enoate Openeye Name: methyl (E)-3-(6-methylsulfanyl-4-oxo-quinazolin-3-yl)prop-2-enoate CAS Name: (E)-3-[6-(methylthio)-4-oxo-3-quinazolinyl]-2-propenoic acid methyl ester IUPAC Name: methyl (E)-3-(6-methylsulfanyl-4-oxoquinazolin-3-yl)prop-2-enoate Traditional Name: (E)-3-[4-keto-6-(methylthio)quinazolin-3-yl]acrylic acid methyl ester Formula: C13H12N2O3S MolecularWeight: 276.31098

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CN1C=NC2=C(C1=O)C=C(C=C2)SC

Isomeric SMILES

COC(=O)/C=C/N1C=NC2=C(C1=O)C=C(C=C2)SC

InChI

InChI=1S/C13H12N2O3S/c1-18-12(16)5-6-15-8-14-11-4-3-9(19-2)7-10(11)13(15)17/h3-8H,1-2H3/b6-5+