6-iodanyl-3-(3-methylphenyl)-2-(1-morpholin-4-yl-1-oxidanylidene-propan-2-yl)sulfanyl-quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(3-methylphenyl)-2-(1-morpholin-4-yl-1-oxidanylidene-propan-2-yl)sulfanyl-quinazolin-4-one Openeye Name: 6-iodo-2-(1-methyl-2-morpholino-2-oxo-ethyl)sulfanyl-3-(m-tolyl)quinazolin-4-one CAS Name: 6-iodo-3-(3-methylphenyl)-2-[[1-(4-morpholinyl)-1-oxopropan-2-yl]thio]-4-quinazolinone IUPAC Name: 6-iodo-3-(3-methylphenyl)-2-(1-morpholin-4-yl-1-oxopropan-2-yl)sulfanylquinazolin-4-one Traditional Name: 6-iodo-2-[(2-keto-1-methyl-2-morpholino-ethyl)thio]-3-(m-tolyl)quinazolin-4-one Formula: C22H22IN3O3S MolecularWeight: 535.39785

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C3=C(C=CC(=C3)I)N=C2SC(C)C(=O)N4CCOCC4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)C3=C(C=CC(=C3)I)N=C2SC(C)C(=O)N4CCOCC4

InChI

InChI=1S/C22H22IN3O3S/c1-14-4-3-5-17(12-14)26-21(28)18-13-16(23)6-7-19(18)24-22(26)30-15(2)20(27)25-8-10-29-11-9-25/h3-7,12-13,15H,8-11H2,1-2H3