N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-(4-methyl-3-piperidin-1-ylsulfonyl-phenyl)-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-[4-methyl-3-(1-piperidylsulfonyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: N-[4-methyl-3-(1-piperidinylsulfonyl)phenyl]-1-[oxo(thiophen-2-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-(4-methyl-3-piperidin-1-ylsulfonylphenyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-(4-methyl-3-piperidinosulfonyl-phenyl)-1-(2-thenoyl)nipecotamide Formula: C23H29N3O4S2 MolecularWeight: 475.62406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C3=CC=CS3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CCCN(C2)C(=O)C3=CC=CS3)S(=O)(=O)N4CCCCC4

InChI

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