1-(5-methylthiophen-2-yl)sulfonyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]piperidine-3-carboxamide

Systemtic Name: 1-(5-methylthiophen-2-yl)sulfonyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]piperidine-3-carboxamide Openeye Name: 1-[(5-methyl-2-thienyl)sulfonyl]-N-[(4-pyrrolidin-1-ylphenyl)methyl]piperidine-3-carboxamide CAS Name: 1-[(5-methyl-2-thiophenyl)sulfonyl]-N-[[4-(1-pyrrolidinyl)phenyl]methyl]-3-piperidinecarboxamide IUPAC Name: 1-(5-methylthiophen-2-yl)sulfonyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]piperidine-3-carboxamide Traditional Name: 1-[(5-methyl-2-thienyl)sulfonyl]-N-(4-pyrrolidinobenzyl)nipecotamide Formula: C22H29N3O3S2 MolecularWeight: 447.61396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=C(C=C3)N4CCCC4

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=C(C=C3)N4CCCC4

InChI

InChI=1S/C22H29N3O3S2/c1-17-6-11-21(29-17)30(27,28)25-14-4-5-19(16-25)22(26)23-15-18-7-9-20(10-8-18)24-12-2-3-13-24/h6-11,19H,2-5,12-16H2,1H3,(H,23,26)