3-(4-butylphenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(4-butylphenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-quinazolin-4-one Openeye Name: 3-(4-butylphenyl)-2-(2-morpholino-2-oxo-ethyl)sulfanyl-quinazolin-4-one CAS Name: 3-(4-butylphenyl)-2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-(4-butylphenyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylquinazolin-4-one Traditional Name: 3-(4-butylphenyl)-2-[(2-keto-2-morpholino-ethyl)thio]quinazolin-4-one Formula: C24H27N3O3S MolecularWeight: 437.55448

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4CCOCC4

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4CCOCC4

InChI

InChI=1S/C24H27N3O3S/c1-2-3-6-18-9-11-19(12-10-18)27-23(29)20-7-4-5-8-21(20)25-24(27)31-17-22(28)26-13-15-30-16-14-26/h4-5,7-12H,2-3,6,13-17H2,1H3