1-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-(4-morpholinosulfonyl-2-nitro-phenyl)-N-(2-thienylmethyl)piperidine-4-carboxamide CAS Name: 1-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-N-(thiophen-2-ylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(4-morpholinosulfonyl-2-nitro-phenyl)-N-(2-thenyl)isonipecotamide Formula: C21H26N4O6S2 MolecularWeight: 494.58434

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCC2=CC=CS2)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)NCC2=CC=CS2)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O6S2/c26-21(22-15-17-2-1-13-32-17)16-5-7-23(8-6-16)19-4-3-18(14-20(19)25(27)28)33(29,30)24-9-11-31-12-10-24/h1-4,13-14,16H,5-12,15H2,(H,22,26)