(Z)-3-[3-(4-chlorophenyl)-3-pyridin-2-yl-propyl]-N'-methyl-1-methylsulfanyl-2-nitro-non-1-ene-1,9-diamine

Systemtic Name: (Z)-3-[3-(4-chlorophenyl)-3-pyridin-2-yl-propyl]-N'-methyl-1-methylsulfanyl-2-nitro-non-1-ene-1,9-diamine Openeye Name: (Z)-3-[3-(4-chlorophenyl)-3-(2-pyridyl)propyl]-N'-methyl-1-methylsulfanyl-2-nitro-non-1-ene-1,9-diamine CAS Name: (Z)-3-[3-(4-chlorophenyl)-3-(2-pyridinyl)propyl]-N'-methyl-1-(methylthio)-2-nitro-1-nonene-1,9-diamine IUPAC Name: (Z)-3-[3-(4-chlorophenyl)-3-pyridin-2-ylpropyl]-N'-methyl-1-methylsulfanyl-2-nitronon-1-ene-1,9-diamine Traditional Name: [(Z)-9-amino-7-[3-(4-chlorophenyl)-3-(2-pyridyl)propyl]-9-(methylthio)-8-nitro-non-8-enyl]-methyl-amine Formula: C25H35ClN4O2S MolecularWeight: 491.089

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Descriptors Computed from Structure

Canonical SMILES:

CNCCCCCCC(CCC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2)C(=C(N)SC)[N+](=O)[O-]

Isomeric SMILES

CNCCCCCCC(CCC(C1=CC=C(C=C1)Cl)C2=CC=CC=N2)/C(=C(\N)/SC)/[N+](=O)[O-]

InChI

InChI=1S/C25H35ClN4O2S/c1-28-17-7-4-3-5-9-20(24(30(31)32)25(27)33-2)13-16-22(23-10-6-8-18-29-23)19-11-14-21(26)15-12-19/h6,8,10-12,14-15,18,20,22,28H,3-5,7,9,13,16-17,27H2,1-2H3/b25-24-