N-[2-[(4-nitrophenyl)amino]ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-[(4-nitrophenyl)amino]ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(4-nitroanilino)ethyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-[2-(4-nitroanilino)ethyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-[2-(4-nitroanilino)ethyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(4-nitroanilino)ethyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C18H22N4O5S2 MolecularWeight: 438.52108

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CS2)C(=O)NCCNC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O5S2/c23-18(20-10-9-19-15-5-7-16(8-6-15)22(24)25)14-3-1-11-21(13-14)29(26,27)17-4-2-12-28-17/h2,4-8,12,14,19H,1,3,9-11,13H2,(H,20,23)