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

Systemtic Name: N-[[3-(dimethylcarbamoyl)phenyl]methyl]-1-(5-methylthiophen-2-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[[3-(dimethylcarbamoyl)phenyl]methyl]-1-[(5-methyl-2-thienyl)sulfonyl]piperidine-3-carboxamide CAS Name: N-[[3-[dimethylamino(oxo)methyl]phenyl]methyl]-1-[(5-methyl-2-thiophenyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[[3-(dimethylcarbamoyl)phenyl]methyl]-1-(5-methylthiophen-2-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[3-(dimethylcarbamoyl)benzyl]-1-[(5-methyl-2-thienyl)sulfonyl]nipecotamide Formula: C21H27N3O4S2 MolecularWeight: 449.58678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O4S2/c1-15-9-10-19(29-15)30(27,28)24-11-5-8-18(14-24)20(25)22-13-16-6-4-7-17(12-16)21(26)23(2)3/h4,6-7,9-10,12,18H,5,8,11,13-14H2,1-3H3,(H,22,25)