N-[cyclopropyl(thiophen-2-yl)methyl]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[cyclopropyl(thiophen-2-yl)methyl]-1-(4-methylphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[cyclopropyl(2-thienyl)methyl]-1-(p-tolylsulfonyl)piperidine-3-carboxamide CAS Name: N-[cyclopropyl(thiophen-2-yl)methyl]-1-(4-methylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-[cyclopropyl(thiophen-2-yl)methyl]-1-(4-methylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[cyclopropyl(2-thienyl)methyl]-1-tosyl-nipecotamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC(C3CC3)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC(C3CC3)C4=CC=CS4

InChI

InChI=1S/C21H26N2O3S2/c1-15-6-10-18(11-7-15)28(25,26)23-12-2-4-17(14-23)21(24)22-20(16-8-9-16)19-5-3-13-27-19/h3,5-7,10-11,13,16-17,20H,2,4,8-9,12,14H2,1H3,(H,22,24)