1-[(4-bromophenyl)sulfanylmethyl]-3-nitro-benzene

Systemtic Name: 1-[(4-bromophenyl)sulfanylmethyl]-3-nitro-benzene Openeye Name: 1-[(4-bromophenyl)sulfanylmethyl]-3-nitro-benzene CAS Name: 1-[[(4-bromophenyl)thio]methyl]-3-nitrobenzene IUPAC Name: 1-[(4-bromophenyl)sulfanylmethyl]-3-nitrobenzene Traditional Name: 1-[[(4-bromophenyl)thio]methyl]-3-nitro-benzene Formula: C13H10BrNO2S MolecularWeight: 324.193

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=CC=C(C=C2)Br

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])CSC2=CC=C(C=C2)Br

InChI

InChI=1S/C13H10BrNO2S/c14-11-4-6-13(7-5-11)18-9-10-2-1-3-12(8-10)15(16)17/h1-8H,9H2