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

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-1-(2,4-dimethylphenyl)sulfonyl-N-methyl-piperidine-4-carboxamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-1-(2,4-dimethylphenyl)sulfonyl-N-methyl-piperidine-4-carboxamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-1-(2,4-dimethylphenyl)sulfonyl-N-methyl-4-piperidinecarboxamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-1-(2,4-dimethylphenyl)sulfonyl-N-methylpiperidine-4-carboxamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-1-(2,4-dimethylphenyl)sulfonyl-N-methyl-isonipecotamide Formula: C21H33N3O4S MolecularWeight: 423.56942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC(=O)NC(C)(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)CC(=O)NC(C)(C)C)C

InChI

InChI=1S/C21H33N3O4S/c1-15-7-8-18(16(2)13-15)29(27,28)24-11-9-17(10-12-24)20(26)23(6)14-19(25)22-21(3,4)5/h7-8,13,17H,9-12,14H2,1-6H3,(H,22,25)