N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1-thiophen-2-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1-(2-thienylsulfonyl)piperidine-3-carboxamide CAS Name: N-methyl-N-[[4-(methylthio)phenyl]methyl]-1-thiophen-2-ylsulfonyl-3-piperidinecarboxamide IUPAC Name: N-methyl-N-[(4-methylsulfanylphenyl)methyl]-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-methyl-N-[4-(methylthio)benzyl]-1-(2-thienylsulfonyl)nipecotamide Formula: C19H24N2O3S3 MolecularWeight: 424.60046

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)C(=O)C2CCCN(C2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H24N2O3S3/c1-20(13-15-7-9-17(25-2)10-8-15)19(22)16-5-3-11-21(14-16)27(23,24)18-6-4-12-26-18/h4,6-10,12,16H,3,5,11,13-14H2,1-2H3