3-methylsulfanyl-N-[(4-nitrophenyl)methyl]aniline

Systemtic Name: 3-methylsulfanyl-N-[(4-nitrophenyl)methyl]aniline Openeye Name: 3-methylsulfanyl-N-[(4-nitrophenyl)methyl]aniline CAS Name: 3-(methylthio)-N-[(4-nitrophenyl)methyl]aniline IUPAC Name: 3-methylsulfanyl-N-[(4-nitrophenyl)methyl]aniline Traditional Name: [3-(methylthio)phenyl]-(4-nitrobenzyl)amine Formula: C14H14N2O2S MolecularWeight: 274.33816

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NCC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=CC(=C1)NCC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H14N2O2S/c1-19-14-4-2-3-12(9-14)15-10-11-5-7-13(8-6-11)16(17)18/h2-9,15H,10H2,1H3