3-bromanyl-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]aniline

Systemtic Name: 3-bromanyl-2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]aniline Openeye Name: 3-bromo-2-[(1-methyltetrazol-5-yl)sulfanylmethyl]aniline CAS Name: 3-bromo-2-[[(1-methyl-5-tetrazolyl)thio]methyl]aniline IUPAC Name: 3-bromo-2-[(1-methyltetrazol-5-yl)sulfanylmethyl]aniline Traditional Name: [3-bromo-2-[[(1-methyltetrazol-5-yl)thio]methyl]phenyl]amine Formula: C9H10BrN5S MolecularWeight: 300.1782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC2=C(C=CC=C2Br)N

Isomeric SMILES

CN1C(=NN=N1)SCC2=C(C=CC=C2Br)N

InChI

InChI=1S/C9H10BrN5S/c1-15-9(12-13-14-15)16-5-6-7(10)3-2-4-8(6)11/h2-4H,5,11H2,1H3