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

Systemtic Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-methyl-N-[[4-(methylthio)phenyl]methyl]-1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-methyl-1-[(5-methyl-2-thienyl)sulfonyl]-N-[4-(methylthio)benzyl]nipecotamide Formula: C20H26N2O3S3 MolecularWeight: 438.62704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)N(C)CC3=CC=C(C=C3)SC

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCCC(C2)C(=O)N(C)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C20H26N2O3S3/c1-15-6-11-19(27-15)28(24,25)22-12-4-5-17(14-22)20(23)21(2)13-16-7-9-18(26-3)10-8-16/h6-11,17H,4-5,12-14H2,1-3H3