N-(3,4-dimethoxyphenyl)-1-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-1-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3,4-dimethoxyphenyl)-1-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3,4-dimethoxyphenyl)-1-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(3,4-dimethoxyphenyl)-1-(1-ethyl-3,5-dimethylpyrazol-4-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3,4-dimethoxyphenyl)-1-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)sulfonyl-isonipecotamide Formula: C21H30N4O5S MolecularWeight: 450.5517

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)OC)OC)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=C(C=C3)OC)OC)C

InChI

InChI=1S/C21H30N4O5S/c1-6-25-15(3)20(14(2)23-25)31(27,28)24-11-9-16(10-12-24)21(26)22-17-7-8-18(29-4)19(13-17)30-5/h7-8,13,16H,6,9-12H2,1-5H3,(H,22,26)