6,7-diethoxy-3-phenethyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6,7-diethoxy-3-phenethyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6,7-diethoxy-3-phenethyl-2-thioxo-1H-quinazolin-4-one CAS Name: 6,7-diethoxy-3-phenethyl-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6,7-diethoxy-3-phenethyl-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6,7-diethoxy-3-phenethyl-2-thioxo-1H-quinazolin-4-one Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O3S/c1-3-24-17-12-15-16(13-18(17)25-4-2)21-20(26)22(19(15)23)11-10-14-8-6-5-7-9-14/h5-9,12-13H,3-4,10-11H2,1-2H3,(H,21,26)