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

Systemtic Name: 2-[(4-azanyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-bromophenyl)ethanamide Openeye Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-bromophenyl)acetamide CAS Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)thio]-N-(2-bromophenyl)acetamide IUPAC Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-bromophenyl)acetamide Traditional Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)thio]-N-(2-bromophenyl)acetamide Formula: C13H16BrN5OS MolecularWeight: 370.26804

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1N)SCC(=O)NC2=CC=CC=C2Br

Isomeric SMILES

CCCC1=NN=C(N1N)SCC(=O)NC2=CC=CC=C2Br

InChI

InChI=1S/C13H16BrN5OS/c1-2-5-11-17-18-13(19(11)15)21-8-12(20)16-10-7-4-3-6-9(10)14/h3-4,6-7H,2,5,8,15H2,1H3,(H,16,20)