N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-1-(3,4-dimethoxyphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-1-(3,4-dimethoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(cyclopropylamino)-2-oxo-ethyl]-1-(3,4-dimethoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(cyclopropylamino)-2-oxoethyl]-1-(3,4-dimethoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(cyclopropylamino)-2-oxoethyl]-1-(3,4-dimethoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(cyclopropylamino)-2-keto-ethyl]-1-(3,4-dimethoxyphenyl)sulfonyl-isonipecotamide Formula: C19H27N3O6S MolecularWeight: 425.49918

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC(=O)NC3CC3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC(=O)NC3CC3)OC

InChI

InChI=1S/C19H27N3O6S/c1-27-16-6-5-15(11-17(16)28-2)29(25,26)22-9-7-13(8-10-22)19(24)20-12-18(23)21-14-3-4-14/h5-6,11,13-14H,3-4,7-10,12H2,1-2H3,(H,20,24)(H,21,23)