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

Systemtic Name: N-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]-N-propyl-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(2-methylanilino)-2-oxo-ethyl]-N-propyl-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(2-methylanilino)-2-oxoethyl]-N-propyl-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-keto-2-(o-toluidino)ethyl]-N-propyl-1-(2-thienylsulfonyl)isonipecotamide Formula: C22H29N3O4S2 MolecularWeight: 463.61336

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C22H29N3O4S2/c1-3-12-24(16-20(26)23-19-8-5-4-7-17(19)2)22(27)18-10-13-25(14-11-18)31(28,29)21-9-6-15-30-21/h4-9,15,18H,3,10-14,16H2,1-2H3,(H,23,26)