(7-methoxy-4-oxidanylidene-quinazolin-3-yl)methyl pyridine-2-carboximidothioate

Systemtic Name: (7-methoxy-4-oxidanylidene-quinazolin-3-yl)methyl pyridine-2-carboximidothioate Openeye Name: (7-methoxy-4-oxo-quinazolin-3-yl)methyl pyridine-2-carboximidothioate CAS Name: 2-pyridinecarboximidothioic acid (7-methoxy-4-oxo-3-quinazolinyl)methyl ester IUPAC Name: (7-methoxy-4-oxoquinazolin-3-yl)methyl pyridine-2-carboximidothioate Traditional Name: pyridine-2-carboximidothioic acid (4-keto-7-methoxy-quinazolin-3-yl)methyl ester Formula: C16H14N4O2S MolecularWeight: 326.37296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=O)N(C=N2)CSC(=N)C3=CC=CC=N3

Isomeric SMILES

COC1=CC2=C(C=C1)C(=O)N(C=N2)CSC(=N)C3=CC=CC=N3

InChI

InChI=1S/C16H14N4O2S/c1-22-11-5-6-12-14(8-11)19-9-20(16(12)21)10-23-15(17)13-4-2-3-7-18-13/h2-9,17H,10H2,1H3