3-(3,5-dimethylphenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-quinazolin-4-one

Systemtic Name: 3-(3,5-dimethylphenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-quinazolin-4-one Openeye Name: 3-(3,5-dimethylphenyl)-2-(2-morpholino-2-oxo-ethyl)sulfanyl-quinazolin-4-one CAS Name: 3-(3,5-dimethylphenyl)-2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 3-(3,5-dimethylphenyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylquinazolin-4-one Traditional Name: 3-(3,5-dimethylphenyl)-2-[(2-keto-2-morpholino-ethyl)thio]quinazolin-4-one Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O3S/c1-15-11-16(2)13-17(12-15)25-21(27)18-5-3-4-6-19(18)23-22(25)29-14-20(26)24-7-9-28-10-8-24/h3-6,11-13H,7-10,14H2,1-2H3