N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N-methyl-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-N-methyl-1-pyridin-3-ylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-N-methyl-1-(3-pyridylsulfonyl)piperidine-4-carboxamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-1-(3-pyridinylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-N-methyl-1-(3-pyridylsulfonyl)isonipecotamide Formula: C18H28N4O4S MolecularWeight: 396.50432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CN(C)C(=O)C1CCN(CC1)S(=O)(=O)C2=CN=CC=C2

Isomeric SMILES

CC(C)(C)NC(=O)CN(C)C(=O)C1CCN(CC1)S(=O)(=O)C2=CN=CC=C2

InChI

InChI=1S/C18H28N4O4S/c1-18(2,3)20-16(23)13-21(4)17(24)14-7-10-22(11-8-14)27(25,26)15-6-5-9-19-12-15/h5-6,9,12,14H,7-8,10-11,13H2,1-4H3,(H,20,23)