2-[[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(diphenylmethyl)propanamide

Systemtic Name: 2-[[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(diphenylmethyl)propanamide Openeye Name: N-benzhydryl-2-[[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 2-[[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(diphenylmethyl)propanamide IUPAC Name: N-benzhydryl-2-[[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-benzhydryl-2-[[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C24H21BrN4OS MolecularWeight: 493.41874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NNC(=N3)C4=CC=CC=C4Br

Isomeric SMILES

CC(C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NNC(=N3)C4=CC=CC=C4Br

InChI

InChI=1S/C24H21BrN4OS/c1-16(31-24-27-22(28-29-24)19-14-8-9-15-20(19)25)23(30)26-21(17-10-4-2-5-11-17)18-12-6-3-7-13-18/h2-16,21H,1H3,(H,26,30)(H,27,28,29)