6-chloranyl-3-(2-methylpropyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-quinazolin-4-one

Systemtic Name: 6-chloranyl-3-(2-methylpropyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-quinazolin-4-one Openeye Name: 6-chloro-3-isobutyl-2-(2-morpholino-2-oxo-ethyl)sulfanyl-quinazolin-4-one CAS Name: 6-chloro-3-(2-methylpropyl)-2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 6-chloro-3-(2-methylpropyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylquinazolin-4-one Traditional Name: 6-chloro-3-isobutyl-2-[(2-keto-2-morpholino-ethyl)thio]quinazolin-4-one Formula: C18H22ClN3O3S MolecularWeight: 395.90358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(=O)N3CCOCC3

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Cl)N=C1SCC(=O)N3CCOCC3

InChI

InChI=1S/C18H22ClN3O3S/c1-12(2)10-22-17(24)14-9-13(19)3-4-15(14)20-18(22)26-11-16(23)21-5-7-25-8-6-21/h3-4,9,12H,5-8,10-11H2,1-2H3