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

Systemtic Name: 1-(2-nitro-4-piperidin-1-ylsulfonyl-phenyl)-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-[2-nitro-4-(1-piperidylsulfonyl)phenyl]-N-(2-thienylmethyl)piperidine-4-carboxamide CAS Name: 1-[2-nitro-4-(1-piperidinylsulfonyl)phenyl]-N-(thiophen-2-ylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-(2-nitro-4-piperidin-1-ylsulfonylphenyl)-N-(thiophen-2-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-(2-nitro-4-piperidinosulfonyl-phenyl)-N-(2-thenyl)isonipecotamide Formula: C22H28N4O5S2 MolecularWeight: 492.61152

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCC(CC3)C(=O)NCC4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)N3CCC(CC3)C(=O)NCC4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C22H28N4O5S2/c27-22(23-16-18-5-4-14-32-18)17-8-12-24(13-9-17)20-7-6-19(15-21(20)26(28)29)33(30,31)25-10-2-1-3-11-25/h4-7,14-15,17H,1-3,8-13,16H2,(H,23,27)