N-(2-bromanyl-4-nitro-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide hydrochloride

Systemtic Name: N-(2-bromanyl-4-nitro-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide hydrochloride Openeye Name: N-(2-bromo-4-nitro-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide hydrochloride CAS Name: N-(2-bromo-4-nitrophenyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide hydrochloride IUPAC Name: N-(2-bromo-4-nitrophenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide hydrochloride Traditional Name: N-(2-bromo-4-nitro-phenyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide hydrochloride Formula: C10H9BrClN5O3S MolecularWeight: 394.63216

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])Br)NC(=O)CSC2=NC=NN2.Cl

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])Br)NC(=O)CSC2=NC=NN2.Cl

InChI

InChI=1S/C10H8BrN5O3S.ClH/c11-7-3-6(16(18)19)1-2-8(7)14-9(17)4-20-10-12-5-13-15-10;/h1-3,5H,4H2,(H,14,17)(H,12,13,15);1H