3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(3-oxidanylpyridin-2-yl)propanamide

Systemtic Name: 3-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(3-oxidanylpyridin-2-yl)propanamide Openeye Name: N-(3-hydroxy-2-pyridyl)-3-(4-oxo-2-thioxo-1H-quinazolin-3-yl)propanamide CAS Name: N-(3-hydroxy-2-pyridinyl)-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide IUPAC Name: N-(3-hydroxypyridin-2-yl)-3-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propanamide Traditional Name: N-(3-hydroxy-2-pyridyl)-3-(4-keto-2-thioxo-1H-quinazolin-3-yl)propionamide Formula: C16H14N4O3S MolecularWeight: 342.37236

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCC(=O)NC3=C(C=CC=N3)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCC(=O)NC3=C(C=CC=N3)O

InChI

InChI=1S/C16H14N4O3S/c21-12-6-3-8-17-14(12)19-13(22)7-9-20-15(23)10-4-1-2-5-11(10)18-16(20)24/h1-6,8,21H,7,9H2,(H,18,24)(H,17,19,22)