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

Systemtic Name: N-[2-(tert-butylamino)-2-oxidanylidene-ethyl]-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(tert-butylamino)-2-oxo-ethyl]-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(tert-butylamino)-2-oxoethyl]-1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(tert-butylamino)-2-oxoethyl]-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(tert-butylamino)-2-keto-ethyl]-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C20H29N3O4S MolecularWeight: 407.52696

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CNC(=O)C1CCN(CC1)S(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)NC(=O)CNC(=O)C1CCN(CC1)S(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C20H29N3O4S/c1-20(2,3)22-18(24)15-21-19(25)17-9-12-23(13-10-17)28(26,27)14-11-16-7-5-4-6-8-16/h4-8,11,14,17H,9-10,12-13,15H2,1-3H3,(H,21,25)(H,22,24)/b14-11+