[4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanoate

Systemtic Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 4-(8-methyl-4-oxidanylidene-quinazolin-3-yl)butanoate Openeye Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] 4-(8-methyl-4-oxo-quinazolin-3-yl)butanoate CAS Name: 4-(8-methyl-4-oxo-3-quinazolinyl)butanoic acid [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] 4-(8-methyl-4-oxoquinazolin-3-yl)butanoate Traditional Name: 4-(4-keto-8-methyl-quinazolin-3-yl)butyric acid [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] ester Formula: C23H24N2O4S2 MolecularWeight: 456.57766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)OC3=C(C=C(C=C3)C4SCCS4)OC

Isomeric SMILES

CC1=CC=CC2=C1N=CN(C2=O)CCCC(=O)OC3=C(C=C(C=C3)C4SCCS4)OC

InChI

InChI=1S/C23H24N2O4S2/c1-15-5-3-6-17-21(15)24-14-25(22(17)27)10-4-7-20(26)29-18-9-8-16(13-19(18)28-2)23-30-11-12-31-23/h3,5-6,8-9,13-14,23H,4,7,10-12H2,1-2H3