5-(6,7-diethoxy-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(pyridin-3-ylmethyl)pentanamide

Systemtic Name: 5-(6,7-diethoxy-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)-N-(pyridin-3-ylmethyl)pentanamide Openeye Name: 5-(6,7-diethoxy-4-oxo-2-thioxo-1H-quinazolin-3-yl)-N-(3-pyridylmethyl)pentanamide CAS Name: 5-(6,7-diethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(3-pyridinylmethyl)pentanamide IUPAC Name: 5-(6,7-diethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)-N-(pyridin-3-ylmethyl)pentanamide Traditional Name: 5-(6,7-diethoxy-4-keto-2-thioxo-1H-quinazolin-3-yl)-N-(3-pyridylmethyl)valeramide Formula: C23H28N4O4S MolecularWeight: 456.55782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCCCC(=O)NCC3=CN=CC=C3)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCCCC(=O)NCC3=CN=CC=C3)OCC

InChI

InChI=1S/C23H28N4O4S/c1-3-30-19-12-17-18(13-20(19)31-4-2)26-23(32)27(22(17)29)11-6-5-9-21(28)25-15-16-8-7-10-24-14-16/h7-8,10,12-14H,3-6,9,11,15H2,1-2H3,(H,25,28)(H,26,32)