5-bromanyl-N-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]furan-2-carboxamide CAS Name: 5-bromo-N-[4-[[(5-methyl-1H-1,2,4-triazol-3-yl)thio]methyl]phenyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[4-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]phenyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[4-[[(5-methyl-1H-1,2,4-triazol-3-yl)thio]methyl]phenyl]-2-furamide Formula: C15H13BrN4O2S MolecularWeight: 393.25832

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)SCC2=CC=C(C=C2)NC(=O)C3=CC=C(O3)Br

Isomeric SMILES

CC1=NC(=NN1)SCC2=CC=C(C=C2)NC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C15H13BrN4O2S/c1-9-17-15(20-19-9)23-8-10-2-4-11(5-3-10)18-14(21)12-6-7-13(16)22-12/h2-7H,8H2,1H3,(H,18,21)(H,17,19,20)