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

Systemtic Name: 3-bromanyl-2-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]aniline Openeye Name: 3-bromo-2-[(1-phenyltetrazol-5-yl)sulfanylmethyl]aniline CAS Name: 3-bromo-2-[[(1-phenyl-5-tetrazolyl)thio]methyl]aniline IUPAC Name: 3-bromo-2-[(1-phenyltetrazol-5-yl)sulfanylmethyl]aniline Traditional Name: [3-bromo-2-[[(1-phenyltetrazol-5-yl)thio]methyl]phenyl]amine Formula: C14H12BrN5S MolecularWeight: 362.24758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCC3=C(C=CC=C3Br)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCC3=C(C=CC=C3Br)N

InChI

InChI=1S/C14H12BrN5S/c15-12-7-4-8-13(16)11(12)9-21-14-17-18-19-20(14)10-5-2-1-3-6-10/h1-8H,9,16H2