6-iodanyl-3-(2-methylphenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(2-methylphenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-quinazolin-4-one Openeye Name: 6-iodo-2-(2-morpholino-2-oxo-ethyl)sulfanyl-3-(o-tolyl)quinazolin-4-one CAS Name: 6-iodo-3-(2-methylphenyl)-2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-4-quinazolinone IUPAC Name: 6-iodo-3-(2-methylphenyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanylquinazolin-4-one Traditional Name: 6-iodo-2-[(2-keto-2-morpholino-ethyl)thio]-3-(o-tolyl)quinazolin-4-one Formula: C21H20IN3O3S MolecularWeight: 521.37127

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)N4CCOCC4

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)N4CCOCC4

InChI

InChI=1S/C21H20IN3O3S/c1-14-4-2-3-5-18(14)25-20(27)16-12-15(22)6-7-17(16)23-21(25)29-13-19(26)24-8-10-28-11-9-24/h2-7,12H,8-11,13H2,1H3