N,N-dimethyl-4-[1-(4-methylphenyl)sulfanyl-2-nitro-ethyl]aniline

Systemtic Name: N,N-dimethyl-4-[1-(4-methylphenyl)sulfanyl-2-nitro-ethyl]aniline Openeye Name: N,N-dimethyl-4-[2-nitro-1-(p-tolylsulfanyl)ethyl]aniline CAS Name: N,N-dimethyl-4-[1-[(4-methylphenyl)thio]-2-nitroethyl]aniline IUPAC Name: N,N-dimethyl-4-[1-(4-methylphenyl)sulfanyl-2-nitroethyl]aniline Traditional Name: dimethyl-[4-[2-nitro-1-(p-tolylthio)ethyl]phenyl]amine Formula: C17H20N2O2S MolecularWeight: 316.4179

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(C[N+](=O)[O-])C2=CC=C(C=C2)N(C)C

Isomeric SMILES

CC1=CC=C(C=C1)SC(C[N+](=O)[O-])C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C17H20N2O2S/c1-13-4-10-16(11-5-13)22-17(12-19(20)21)14-6-8-15(9-7-14)18(2)3/h4-11,17H,12H2,1-3H3