1-(4-bromophenyl)-2-[4-phenyl-3-(phenylsulfanylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]ethanone

Systemtic Name: 1-(4-bromophenyl)-2-[4-phenyl-3-(phenylsulfanylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]ethanone Openeye Name: 1-(4-bromophenyl)-2-[4-phenyl-3-(phenylsulfanylmethyl)-5-thioxo-1,2,4-triazol-1-yl]ethanone CAS Name: 1-(4-bromophenyl)-2-[4-phenyl-3-[(phenylthio)methyl]-5-sulfanylidene-1,2,4-triazol-1-yl]ethanone IUPAC Name: 1-(4-bromophenyl)-2-[4-phenyl-3-(phenylsulfanylmethyl)-5-sulfanylidene-1,2,4-triazol-1-yl]ethanone Traditional Name: 1-(4-bromophenyl)-2-[4-phenyl-3-[(phenylthio)methyl]-5-thioxo-1,2,4-triazol-1-yl]ethanone Formula: C23H18BrN3OS2 MolecularWeight: 496.44252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN(C2=S)CC(=O)C3=CC=C(C=C3)Br)CSC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN(C2=S)CC(=O)C3=CC=C(C=C3)Br)CSC4=CC=CC=C4

InChI

InChI=1S/C23H18BrN3OS2/c24-18-13-11-17(12-14-18)21(28)15-26-23(29)27(19-7-3-1-4-8-19)22(25-26)16-30-20-9-5-2-6-10-20/h1-14H,15-16H2