2-[[5-(4-bromophenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: 2-[[5-(4-bromophenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-(4-bromophenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[5-(4-bromophenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[[5-(4-bromophenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: 2-[[5-(4-bromophenyl)-4-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H15BrN4O2S MolecularWeight: 419.2956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N)C3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)N)C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H15BrN4O2S/c1-24-14-8-6-13(7-9-14)22-16(11-2-4-12(18)5-3-11)20-21-17(22)25-10-15(19)23/h2-9H,10H2,1H3,(H2,19,23)