N-[[2-(dimethylaminomethyl)phenyl]methyl]-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[[2-(dimethylaminomethyl)phenyl]methyl]-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[2-(dimethylaminomethyl)benzyl]-1-[(5-methyl-2-thienyl)sulfonyl]nipecotamide Formula: C21H29N3O3S2 MolecularWeight: 435.60326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=CC=C3CN(C)C

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)NCC3=CC=CC=C3CN(C)C

InChI

InChI=1S/C21H29N3O3S2/c1-16-10-11-20(28-16)29(26,27)24-12-6-9-19(15-24)21(25)22-13-17-7-4-5-8-18(17)14-23(2)3/h4-5,7-8,10-11,19H,6,9,12-15H2,1-3H3,(H,22,25)