1-(3,4-dimethylphenyl)sulfonyl-N-methyl-N-[(5-methylfuran-2-yl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dimethylphenyl)sulfonyl-N-methyl-N-[(5-methylfuran-2-yl)methyl]piperidine-4-carboxamide Openeye Name: 1-(3,4-dimethylphenyl)sulfonyl-N-methyl-N-[(5-methyl-2-furyl)methyl]piperidine-4-carboxamide CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-N-methyl-N-[(5-methyl-2-furanyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dimethylphenyl)sulfonyl-N-methyl-N-[(5-methylfuran-2-yl)methyl]piperidine-4-carboxamide Traditional Name: 1-(3,4-dimethylphenyl)sulfonyl-N-methyl-N-[(5-methyl-2-furyl)methyl]isonipecotamide Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC=C(O3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC3=CC=C(O3)C)C

InChI

InChI=1S/C21H28N2O4S/c1-15-5-8-20(13-16(15)2)28(25,26)23-11-9-18(10-12-23)21(24)22(4)14-19-7-6-17(3)27-19/h5-8,13,18H,9-12,14H2,1-4H3