N-[(2-methoxypyridin-3-yl)methyl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide

Systemtic Name: N-[(2-methoxypyridin-3-yl)methyl]-3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Openeye Name: N-[(2-methoxy-3-pyridyl)methyl]-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-[(2-methoxy-3-pyridinyl)methyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-[(2-methoxypyridin-3-yl)methyl]-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: 3-(4-keto-2-thioxo-1H-quinazolin-3-yl)-N-[(2-methoxy-3-pyridyl)methyl]propionamide Formula: C18H18N4O3S MolecularWeight: 370.42552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC=N1)CNC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

COC1=C(C=CC=N1)CNC(=O)CCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C18H18N4O3S/c1-25-16-12(5-4-9-19-16)11-20-15(23)8-10-22-17(24)13-6-2-3-7-14(13)21-18(22)26/h2-7,9H,8,10-11H2,1H3,(H,20,23)(H,21,26)