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

Systemtic Name: N-[2-[[5-bromanyl-2-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[2-[(2-benzyl-5-bromo-1,2,4-triazol-3-yl)sulfanyl]phenyl]cyclopropanecarboxamide CAS Name: N-[2-[[5-bromo-2-(phenylmethyl)-1,2,4-triazol-3-yl]thio]phenyl]cyclopropanecarboxamide IUPAC Name: N-[2-[(2-benzyl-5-bromo-1,2,4-triazol-3-yl)sulfanyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[2-[(2-benzyl-5-bromo-1,2,4-triazol-3-yl)thio]phenyl]cyclopropanecarboxamide Formula: C19H17BrN4OS MolecularWeight: 429.33348

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=CC=C2SC3=NC(=NN3CC4=CC=CC=C4)Br

Isomeric SMILES

C1CC1C(=O)NC2=CC=CC=C2SC3=NC(=NN3CC4=CC=CC=C4)Br

InChI

InChI=1S/C19H17BrN4OS/c20-18-22-19(24(23-18)12-13-6-2-1-3-7-13)26-16-9-5-4-8-15(16)21-17(25)14-10-11-14/h1-9,14H,10-12H2,(H,21,25)