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

Systemtic Name: N-[2-[ethyl-(2-methylphenyl)amino]ethyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(N-ethyl-2-methyl-anilino)ethyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(N-ethyl-2-methylanilino)ethyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(N-ethyl-2-methylanilino)ethyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(N-ethyl-2-methyl-anilino)ethyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C21H29N3O3S2 MolecularWeight: 435.60326

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CS2)C3=CC=CC=C3C

Isomeric SMILES

CCN(CCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CS2)C3=CC=CC=C3C

InChI

InChI=1S/C21H29N3O3S2/c1-3-23(19-8-5-4-7-17(19)2)15-12-22-21(25)18-10-13-24(14-11-18)29(26,27)20-9-6-16-28-20/h4-9,16,18H,3,10-15H2,1-2H3,(H,22,25)