4,5-bis(4-chlorophenyl)-2-(3-iodanylprop-2-ynyl)-1,2,4-triazol-3-one

Systemtic Name: 4,5-bis(4-chlorophenyl)-2-(3-iodanylprop-2-ynyl)-1,2,4-triazol-3-one Openeye Name: 4,5-bis(4-chlorophenyl)-2-(3-iodoprop-2-ynyl)-1,2,4-triazol-3-one CAS Name: 4,5-bis(4-chlorophenyl)-2-(3-iodoprop-2-ynyl)-1,2,4-triazol-3-one IUPAC Name: 4,5-bis(4-chlorophenyl)-2-(3-iodoprop-2-ynyl)-1,2,4-triazol-3-one Traditional Name: 4,5-bis(4-chlorophenyl)-2-(3-iodoprop-2-ynyl)-1,2,4-triazol-3-one Formula: C17H10Cl2IN3O MolecularWeight: 470.09127

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C(=O)N2C3=CC=C(C=C3)Cl)CC#CI)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NN(C(=O)N2C3=CC=C(C=C3)Cl)CC#CI)Cl

InChI

InChI=1S/C17H10Cl2IN3O/c18-13-4-2-12(3-5-13)16-21-22(11-1-10-20)17(24)23(16)15-8-6-14(19)7-9-15/h2-9H,11H2