N-methyl-1-(5-methylthiophen-2-yl)sulfonyl-N-[1-(3-nitrophenyl)ethyl]piperidine-3-carboxamide

Systemtic Name: N-methyl-1-(5-methylthiophen-2-yl)sulfonyl-N-[1-(3-nitrophenyl)ethyl]piperidine-3-carboxamide Openeye Name: N-methyl-1-[(5-methyl-2-thienyl)sulfonyl]-N-[1-(3-nitrophenyl)ethyl]piperidine-3-carboxamide CAS Name: N-methyl-1-[(5-methyl-2-thiophenyl)sulfonyl]-N-[1-(3-nitrophenyl)ethyl]-3-piperidinecarboxamide IUPAC Name: N-methyl-1-(5-methylthiophen-2-yl)sulfonyl-N-[1-(3-nitrophenyl)ethyl]piperidine-3-carboxamide Traditional Name: N-methyl-1-[(5-methyl-2-thienyl)sulfonyl]-N-[1-(3-nitrophenyl)ethyl]nipecotamide Formula: C20H25N3O5S2 MolecularWeight: 451.5596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)N(C)C(C)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)N(C)C(C)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H25N3O5S2/c1-14-9-10-19(29-14)30(27,28)22-11-5-7-17(13-22)20(24)21(3)15(2)16-6-4-8-18(12-16)23(25)26/h4,6,8-10,12,15,17H,5,7,11,13H2,1-3H3