(4-oxidanylidene-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidin-7-yl)methyl 2-methylpropanoate

Systemtic Name: (4-oxidanylidene-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidin-7-yl)methyl 2-methylpropanoate Openeye Name: (4-oxo-2-thioxo-1,5-dihydrochromeno[2,3-d]pyrimidin-7-yl)methyl 2-methylpropanoate CAS Name: 2-methylpropanoic acid (4-oxo-2-sulfanylidene-1,5-dihydro[1]benzopyrano[2,3-d]pyrimidin-7-yl)methyl ester IUPAC Name: (4-oxo-2-sulfanylidene-1,5-dihydrochromeno[2,3-d]pyrimidin-7-yl)methyl 2-methylpropanoate Traditional Name: 2-methylpropionic acid (4-keto-2-thioxo-1,5-dihydrochromeno[2,3-d]pyrimidin-7-yl)methyl ester Formula: C16H16N2O4S MolecularWeight: 332.37424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)OCC1=CC2=C(C=C1)OC3=C(C2)C(=O)NC(=S)N3

Isomeric SMILES

CC(C)C(=O)OCC1=CC2=C(C=C1)OC3=C(C2)C(=O)NC(=S)N3

InChI

InChI=1S/C16H16N2O4S/c1-8(2)15(20)21-7-9-3-4-12-10(5-9)6-11-13(19)17-16(23)18-14(11)22-12/h3-5,8H,6-7H2,1-2H3,(H2,17,18,19,23)