6-iodanyl-3-(4-phenylphenyl)carbonyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(4-phenylphenyl)carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6-iodo-3-(4-phenylbenzoyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 6-iodo-3-[oxo-(4-phenylphenyl)methyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6-iodo-3-(4-phenylbenzoyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6-iodo-3-(4-phenylbenzoyl)-2-thioxo-1H-quinazolin-4-one Formula: C21H13IN2O2S MolecularWeight: 484.30959

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)N3C(=O)C4=C(C=CC(=C4)I)NC3=S

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)N3C(=O)C4=C(C=CC(=C4)I)NC3=S

InChI

InChI=1S/C21H13IN2O2S/c22-16-10-11-18-17(12-16)20(26)24(21(27)23-18)19(25)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-12H,(H,23,27)