N,N-diethyl-3-(4-nitrophenyl)sulfanyl-aniline

Systemtic Name: N,N-diethyl-3-(4-nitrophenyl)sulfanyl-aniline Openeye Name: N,N-diethyl-3-(4-nitrophenyl)sulfanyl-aniline CAS Name: N,N-diethyl-3-[(4-nitrophenyl)thio]aniline IUPAC Name: N,N-diethyl-3-(4-nitrophenyl)sulfanylaniline Traditional Name: diethyl-[3-[(4-nitrophenyl)thio]phenyl]amine Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=CC=C1)SC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=CC(=CC=C1)SC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O2S/c1-3-17(4-2)14-6-5-7-16(12-14)21-15-10-8-13(9-11-15)18(19)20/h5-12H,3-4H2,1-2H3