N-(2,5-diethoxyphenyl)-1-(1-methylimidazol-4-yl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(2,5-diethoxyphenyl)-1-(1-methylimidazol-4-yl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(2,5-diethoxyphenyl)-1-(1-methylimidazol-4-yl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(2,5-diethoxyphenyl)-1-[(1-methyl-4-imidazolyl)sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(2,5-diethoxyphenyl)-1-(1-methylimidazol-4-yl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(2,5-diethoxyphenyl)-1-(1-methylimidazol-4-yl)sulfonyl-isonipecotamide Formula: C20H28N4O5S MolecularWeight: 436.52512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN(C=N3)C

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CN(C=N3)C

InChI

InChI=1S/C20H28N4O5S/c1-4-28-16-6-7-18(29-5-2)17(12-16)22-20(25)15-8-10-24(11-9-15)30(26,27)19-13-23(3)14-21-19/h6-7,12-15H,4-5,8-11H2,1-3H3,(H,22,25)