N-[1-(2,4-dimethylphenyl)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(2,4-dimethylphenyl)ethyl]-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(2,4-dimethylphenyl)ethyl]-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[1-(2,4-dimethylphenyl)ethyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(2,4-dimethylphenyl)ethyl]-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(2,4-dimethylphenyl)ethyl]-1-(2-thienylsulfonyl)isonipecotamide Formula: C20H26N2O3S2 MolecularWeight: 406.56204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3)C

InChI

InChI=1S/C20H26N2O3S2/c1-14-6-7-18(15(2)13-14)16(3)21-20(23)17-8-10-22(11-9-17)27(24,25)19-5-4-12-26-19/h4-7,12-13,16-17H,8-11H2,1-3H3,(H,21,23)