3-(3-chloranyl-4-methyl-phenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-quinazolin-4-one Openeye Name: 3-(3-chloro-4-methyl-phenyl)-2-(2-morpholino-2-oxo-ethyl)sulfanyl-quinazolin-4-one CAS Name: 3-(3-chloro-4-methylphenyl)-2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-(3-chloro-4-methylphenyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylquinazolin-4-one Traditional Name: 3-(3-chloro-4-methyl-phenyl)-2-[(2-keto-2-morpholino-ethyl)thio]quinazolin-4-one Formula: C21H20ClN3O3S MolecularWeight: 429.9198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4CCOCC4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)N4CCOCC4)Cl

InChI

InChI=1S/C21H20ClN3O3S/c1-14-6-7-15(12-17(14)22)25-20(27)16-4-2-3-5-18(16)23-21(25)29-13-19(26)24-8-10-28-11-9-24/h2-7,12H,8-11,13H2,1H3