N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-1-thiophen-2-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-1-(2-thienylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-methyl-4-(1-pyrrolidinyl)phenyl]-1-thiophen-2-ylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-(2-methyl-4-pyrrolidin-1-ylphenyl)-1-thiophen-2-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-(2-methyl-4-pyrrolidino-phenyl)-1-(2-thienylsulfonyl)isonipecotamide Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H27N3O3S2/c1-16-15-18(23-10-2-3-11-23)6-7-19(16)22-21(25)17-8-12-24(13-9-17)29(26,27)20-5-4-14-28-20/h4-7,14-15,17H,2-3,8-13H2,1H3,(H,22,25)