N-butan-2-yl-N-(phenylmethyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-butan-2-yl-N-(phenylmethyl)-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-benzyl-N-sec-butyl-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-butan-2-yl-N-(phenylmethyl)-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-benzyl-N-butan-2-yl-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-benzyl-N-sec-butyl-1-(2-thienylsulfonyl)nipecotamide Formula: C21H28N2O3S2 MolecularWeight: 420.58862

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=CC=C1)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCC(C)N(CC1=CC=CC=C1)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H28N2O3S2/c1-3-17(2)23(15-18-9-5-4-6-10-18)21(24)19-11-7-13-22(16-19)28(25,26)20-12-8-14-27-20/h4-6,8-10,12,14,17,19H,3,7,11,13,15-16H2,1-2H3