N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[2-methyl-5-(1-piperidylsulfonyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: N-[2-methyl-5-(1-piperidinylsulfonyl)phenyl]-1-[oxo(thiophen-2-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-(2-methyl-5-piperidin-1-ylsulfonylphenyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-(2-methyl-5-piperidinosulfonyl-phenyl)-1-(2-thenoyl)nipecotamide Formula: C23H29N3O4S2 MolecularWeight: 475.62406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3CCCN(C3)C(=O)C4=CC=CS4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3CCCN(C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C23H29N3O4S2/c1-17-9-10-19(32(29,30)26-12-3-2-4-13-26)15-20(17)24-22(27)18-7-5-11-25(16-18)23(28)21-8-6-14-31-21/h6,8-10,14-15,18H,2-5,7,11-13,16H2,1H3,(H,24,27)