6-iodanyl-2-[2-oxidanylidene-2-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)ethyl]sulfanyl-3-phenyl-quinazolin-4-one

Systemtic Name: 6-iodanyl-2-[2-oxidanylidene-2-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)ethyl]sulfanyl-3-phenyl-quinazolin-4-one Openeye Name: 6-iodo-2-[2-oxo-2-(5-thioxo-1,2-dihydro-1,2,4-triazol-3-yl)ethyl]sulfanyl-3-phenyl-quinazolin-4-one CAS Name: 6-iodo-2-[[2-oxo-2-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)ethyl]thio]-3-phenyl-4-quinazolinone IUPAC Name: 6-iodo-2-[2-oxo-2-(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)ethyl]sulfanyl-3-phenylquinazolin-4-one Traditional Name: 6-iodo-2-[[2-keto-2-(5-thioxo-1,2-dihydro-1,2,4-triazol-3-yl)ethyl]thio]-3-phenyl-quinazolin-4-one Formula: C18H12IN5O2S2 MolecularWeight: 521.35465

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)C4=NC(=S)NN4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=C(C=CC(=C3)I)N=C2SCC(=O)C4=NC(=S)NN4

InChI

InChI=1S/C18H12IN5O2S2/c19-10-6-7-13-12(8-10)16(26)24(11-4-2-1-3-5-11)18(20-13)28-9-14(25)15-21-17(27)23-22-15/h1-8H,9H2,(H2,21,22,23,27)