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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)CSC2=NC3=C(C=C(C=C3)I)C(=O)N2CC4=CC=CC=C4

Isomeric SMILES

C1COCCN1C(=O)CSC2=NC3=C(C=C(C=C3)I)C(=O)N2CC4=CC=CC=C4

InChI

InChI=1S/C21H20IN3O3S/c22-16-6-7-18-17(12-16)20(27)25(13-15-4-2-1-3-5-15)21(23-18)29-14-19(26)24-8-10-28-11-9-24/h1-7,12H,8-11,13-14H2