cyclohexyl 4-oxidanylidene-4-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-butanoate

Systemtic Name: cyclohexyl 4-oxidanylidene-4-(4-oxidanylidene-3-phenyl-quinazolin-2-yl)sulfanyl-butanoate Openeye Name: cyclohexyl 4-oxo-4-(4-oxo-3-phenyl-quinazolin-2-yl)sulfanyl-butanoate CAS Name: 4-oxo-4-[(4-oxo-3-phenyl-2-quinazolinyl)thio]butanoic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-oxo-4-(4-oxo-3-phenylquinazolin-2-yl)sulfanylbutanoate Traditional Name: 4-keto-4-[(4-keto-3-phenyl-quinazolin-2-yl)thio]butyric acid cyclohexyl ester Formula: C24H24N2O4S MolecularWeight: 436.52336

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)CCC(=O)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)OC(=O)CCC(=O)SC2=NC3=CC=CC=C3C(=O)N2C4=CC=CC=C4

InChI

InChI=1S/C24H24N2O4S/c27-21(30-18-11-5-2-6-12-18)15-16-22(28)31-24-25-20-14-8-7-13-19(20)23(29)26(24)17-9-3-1-4-10-17/h1,3-4,7-10,13-14,18H,2,5-6,11-12,15-16H2