2-[2-(9H-fluoren-2-yl)-2-oxidanylidene-ethyl]sulfanyl-6-iodanyl-3-phenyl-quinazolin-4-one

Systemtic Name: 2-[2-(9H-fluoren-2-yl)-2-oxidanylidene-ethyl]sulfanyl-6-iodanyl-3-phenyl-quinazolin-4-one Openeye Name: 2-[2-(9H-fluoren-2-yl)-2-oxo-ethyl]sulfanyl-6-iodo-3-phenyl-quinazolin-4-one CAS Name: 2-[[2-(9H-fluoren-2-yl)-2-oxoethyl]thio]-6-iodo-3-phenyl-4-quinazolinone IUPAC Name: 2-[2-(9H-fluoren-2-yl)-2-oxoethyl]sulfanyl-6-iodo-3-phenylquinazolin-4-one Traditional Name: 2-[[2-(9H-fluoren-2-yl)-2-keto-ethyl]thio]-6-iodo-3-phenyl-quinazolin-4-one Formula: C29H19IN2O2S MolecularWeight: 586.44283

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C3=C1C=C(C=C3)C(=O)CSC4=NC5=C(C=C(C=C5)I)C(=O)N4C6=CC=CC=C6

Isomeric SMILES

C1C2=CC=CC=C2C3=C1C=C(C=C3)C(=O)CSC4=NC5=C(C=C(C=C5)I)C(=O)N4C6=CC=CC=C6

InChI

InChI=1S/C29H19IN2O2S/c30-21-11-13-26-25(16-21)28(34)32(22-7-2-1-3-8-22)29(31-26)35-17-27(33)19-10-12-24-20(15-19)14-18-6-4-5-9-23(18)24/h1-13,15-16H,14,17H2