2-nitro-5-(phenylmethylsulfanyl)aniline

Systemtic Name: 2-nitro-5-(phenylmethylsulfanyl)aniline Openeye Name: 5-benzylsulfanyl-2-nitro-aniline CAS Name: 2-nitro-5-(phenylmethylthio)aniline IUPAC Name: 5-benzylsulfanyl-2-nitroaniline Traditional Name: [5-(benzylthio)-2-nitro-phenyl]amine Formula: C13H12N2O2S MolecularWeight: 260.31158

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N2O2S/c14-12-8-11(6-7-13(12)15(16)17)18-9-10-4-2-1-3-5-10/h1-8H,9,14H2