2-[2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl-methyl-amino]-N-(2-bromophenyl)ethanamide

Systemtic Name: 2-[2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl-methyl-amino]-N-(2-bromophenyl)ethanamide Openeye Name: 2-[[2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-methyl-amino]-N-(2-bromophenyl)acetamide CAS Name: 2-[[2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-methylamino]-N-(2-bromophenyl)acetamide IUPAC Name: 2-[[2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-methylamino]-N-(2-bromophenyl)acetamide Traditional Name: 2-[[2-[(4-amino-5-methyl-1,2,4-triazol-3-yl)thio]acetyl]-methyl-amino]-N-(2-bromophenyl)acetamide Formula: C14H17BrN6O2S MolecularWeight: 413.29278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1N)SCC(=O)N(C)CC(=O)NC2=CC=CC=C2Br

Isomeric SMILES

CC1=NN=C(N1N)SCC(=O)N(C)CC(=O)NC2=CC=CC=C2Br

InChI

InChI=1S/C14H17BrN6O2S/c1-9-18-19-14(21(9)16)24-8-13(23)20(2)7-12(22)17-11-6-4-3-5-10(11)15/h3-6H,7-8,16H2,1-2H3,(H,17,22)