6,7-diethoxy-3-[2-(4-methylphenyl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6,7-diethoxy-3-[2-(4-methylphenyl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6,7-diethoxy-3-[2-(p-tolyl)ethyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 6,7-diethoxy-3-[2-(4-methylphenyl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6,7-diethoxy-3-[2-(4-methylphenyl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6,7-diethoxy-3-[2-(p-tolyl)ethyl]-2-thioxo-1H-quinazolin-4-one Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCC3=CC=C(C=C3)C)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCC3=CC=C(C=C3)C)OCC

InChI

InChI=1S/C21H24N2O3S/c1-4-25-18-12-16-17(13-19(18)26-5-2)22-21(27)23(20(16)24)11-10-15-8-6-14(3)7-9-15/h6-9,12-13H,4-5,10-11H2,1-3H3,(H,22,27)