1-[1-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-3,5-dimethyl-pyrazol-4-yl]sulfonyl-N-methyl-piperidine-4-carboxamide

Systemtic Name: 1-[1-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-3,5-dimethyl-pyrazol-4-yl]sulfonyl-N-methyl-piperidine-4-carboxamide Openeye Name: 1-[1-[2-(tert-butylamino)-2-oxo-ethyl]-3,5-dimethyl-pyrazol-4-yl]sulfonyl-N-methyl-piperidine-4-carboxamide CAS Name: 1-[[1-[2-(tert-butylamino)-2-oxoethyl]-3,5-dimethyl-4-pyrazolyl]sulfonyl]-N-methyl-4-piperidinecarboxamide IUPAC Name: 1-[1-[2-(tert-butylamino)-2-oxoethyl]-3,5-dimethylpyrazol-4-yl]sulfonyl-N-methylpiperidine-4-carboxamide Traditional Name: 1-[1-[2-(tert-butylamino)-2-keto-ethyl]-3,5-dimethyl-pyrazol-4-yl]sulfonyl-N-methyl-isonipecotamide Formula: C18H31N5O4S MolecularWeight: 413.53484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC(C)(C)C)C)S(=O)(=O)N2CCC(CC2)C(=O)NC

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC(C)(C)C)C)S(=O)(=O)N2CCC(CC2)C(=O)NC

InChI

InChI=1S/C18H31N5O4S/c1-12-16(13(2)23(21-12)11-15(24)20-18(3,4)5)28(26,27)22-9-7-14(8-10-22)17(25)19-6/h14H,7-11H2,1-6H3,(H,19,25)(H,20,24)