3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-(4-ethoxyphenyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-(4-ethoxyphenyl)-1,2,4-triazol-4-amine Openeye Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-(4-ethoxyphenyl)-1,2,4-triazol-4-amine CAS Name: 3-[2-(4-bromophenyl)sulfonylethylthio]-5-(4-ethoxyphenyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5-(4-ethoxyphenyl)-1,2,4-triazol-4-amine Traditional Name: [3-(2-brosylethylthio)-5-p-phenetyl-1,2,4-triazol-4-yl]amine Formula: C18H19BrN4O3S2 MolecularWeight: 483.40246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NN=C(N2N)SCCS(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(N2N)SCCS(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H19BrN4O3S2/c1-2-26-15-7-3-13(4-8-15)17-21-22-18(23(17)20)27-11-12-28(24,25)16-9-5-14(19)6-10-16/h3-10H,2,11-12,20H2,1H3