N,N-dimethyl-N'-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)-1-thiophen-2-yl-ethane-1,2-diamine

Systemtic Name: N,N-dimethyl-N'-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)-1-thiophen-2-yl-ethane-1,2-diamine Openeye Name: N,N-dimethyl-N'-[2-nitro-4-(1-piperidylsulfonyl)phenyl]-1-(2-thienyl)ethane-1,2-diamine CAS Name: N,N-dimethyl-N'-[2-nitro-4-(1-piperidinylsulfonyl)phenyl]-1-thiophen-2-ylethane-1,2-diamine IUPAC Name: N,N-dimethyl-N'-(2-nitro-4-piperidin-1-ylsulfonylphenyl)-1-thiophen-2-ylethane-1,2-diamine Traditional Name: dimethyl-[2-(2-nitro-4-piperidinosulfonyl-anilino)-1-(2-thienyl)ethyl]amine Formula: C19H26N4O4S2 MolecularWeight: 438.56414

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

CN(C)C(CNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)[N+](=O)[O-])C3=CC=CS3

InChI

InChI=1S/C19H26N4O4S2/c1-21(2)18(19-7-6-12-28-19)14-20-16-9-8-15(13-17(16)23(24)25)29(26,27)22-10-4-3-5-11-22/h6-9,12-13,18,20H,3-5,10-11,14H2,1-2H3