N-[(4-bromophenyl)carbamoyl]-2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(4-bromophenyl)carbamoyl]-2-[(4-butyl-5-oxidanylidene-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(4-bromophenyl)carbamoyl]-2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[(4-bromoanilino)-oxomethyl]-2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(4-bromophenyl)carbamoyl]-2-[(4-butyl-5-oxo-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[(4-bromophenyl)carbamoyl]-2-[(4-butyl-5-keto-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C15H18BrN5O3S MolecularWeight: 428.30412

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)NN=C1SCC(=O)NC(=O)NC2=CC=C(C=C2)Br

Isomeric SMILES

CCCCN1C(=O)NN=C1SCC(=O)NC(=O)NC2=CC=C(C=C2)Br

InChI

InChI=1S/C15H18BrN5O3S/c1-2-3-8-21-14(24)19-20-15(21)25-9-12(22)18-13(23)17-11-6-4-10(16)5-7-11/h4-7H,2-3,8-9H2,1H3,(H,19,24)(H2,17,18,22,23)