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

Systemtic Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-methyl-N-[1-(3-nitrophenyl)ethyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C19H23N3O5S2 MolecularWeight: 437.53302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H23N3O5S2/c1-14(15-6-3-8-17(12-15)22(24)25)20(2)19(23)16-7-4-10-21(13-16)29(26,27)18-9-5-11-28-18/h3,5-6,8-9,11-12,14,16H,4,7,10,13H2,1-2H3