N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-1-(2-cyanophenyl)sulfonyl-N-ethyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-1-(2-cyanophenyl)sulfonyl-N-ethyl-piperidine-4-carboxamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-1-(2-cyanophenyl)sulfonyl-N-ethyl-piperidine-4-carboxamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-1-(2-cyanophenyl)sulfonyl-N-ethyl-4-piperidinecarboxamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-1-(2-cyanophenyl)sulfonyl-N-ethylpiperidine-4-carboxamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-1-(2-cyanophenyl)sulfonyl-N-ethyl-isonipecotamide Formula: C21H30N4O4S MolecularWeight: 434.5523

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC(C)(C)C)C(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C#N

Isomeric SMILES

CCN(CC(=O)NC(C)(C)C)C(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C#N

InChI

InChI=1S/C21H30N4O4S/c1-5-24(15-19(26)23-21(2,3)4)20(27)16-10-12-25(13-11-16)30(28,29)18-9-7-6-8-17(18)14-22/h6-9,16H,5,10-13,15H2,1-4H3,(H,23,26)