N-[2-[[5-bromanyl-2-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]phenyl]butanamide

Systemtic Name: N-[2-[[5-bromanyl-2-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]phenyl]butanamide Openeye Name: N-[2-[(2-benzyl-5-bromo-1,2,4-triazol-3-yl)sulfanyl]phenyl]butanamide CAS Name: N-[2-[[5-bromo-2-(phenylmethyl)-1,2,4-triazol-3-yl]thio]phenyl]butanamide IUPAC Name: N-[2-[(2-benzyl-5-bromo-1,2,4-triazol-3-yl)sulfanyl]phenyl]butanamide Traditional Name: N-[2-[(2-benzyl-5-bromo-1,2,4-triazol-3-yl)thio]phenyl]butyramide Formula: C19H19BrN4OS MolecularWeight: 431.34936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=CC=C1SC2=NC(=NN2CC3=CC=CC=C3)Br

Isomeric SMILES

CCCC(=O)NC1=CC=CC=C1SC2=NC(=NN2CC3=CC=CC=C3)Br

InChI

InChI=1S/C19H19BrN4OS/c1-2-8-17(25)21-15-11-6-7-12-16(15)26-19-22-18(20)23-24(19)13-14-9-4-3-5-10-14/h3-7,9-12H,2,8,13H2,1H3,(H,21,25)