N-(2-bromophenyl)-2-[2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]ethanamide

Systemtic Name: N-(2-bromophenyl)-2-[2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]ethanamide Openeye Name: N-(2-bromophenyl)-2-[[2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetamide CAS Name: N-(2-bromophenyl)-2-[[1-oxo-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]ethyl]amino]acetamide IUPAC Name: N-(2-bromophenyl)-2-[[2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]acetamide Traditional Name: N-(2-bromophenyl)-2-[[2-[(1-phenyl-1,2,4-triazol-3-yl)thio]acetyl]amino]acetamide Formula: C18H16BrN5O2S MolecularWeight: 446.32094

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=NC(=N2)SCC(=O)NCC(=O)NC3=CC=CC=C3Br

Isomeric SMILES

C1=CC=C(C=C1)N2C=NC(=N2)SCC(=O)NCC(=O)NC3=CC=CC=C3Br

InChI

InChI=1S/C18H16BrN5O2S/c19-14-8-4-5-9-15(14)22-16(25)10-20-17(26)11-27-18-21-12-24(23-18)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,20,26)(H,22,25)