2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-iodanyl-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanyl-6-iodanyl-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-2-[2-(4-bromophenyl)-2-oxo-ethyl]sulfanyl-6-iodo-quinazolin-4-one CAS Name: 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]-6-iodo-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-2-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-6-iodoquinazolin-4-one Traditional Name: 3-benzyl-2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]-6-iodo-quinazolin-4-one Formula: C23H16BrIN2O2S MolecularWeight: 591.25881

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C23H16BrIN2O2S/c24-17-8-6-16(7-9-17)21(28)14-30-23-26-20-11-10-18(25)12-19(20)22(29)27(23)13-15-4-2-1-3-5-15/h1-12H,13-14H2