N-[2-[ethyl-(2-methylphenyl)amino]ethyl]-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[2-[ethyl-(2-methylphenyl)amino]ethyl]-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[2-(N-ethyl-2-methyl-anilino)ethyl]-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[2-(N-ethyl-2-methylanilino)ethyl]-1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[2-(N-ethyl-2-methylanilino)ethyl]-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-[2-(N-ethyl-2-methyl-anilino)ethyl]-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCNC(=O)C1CCN(CC1)S(=O)(=O)C=CC2=CC=CC=C2)C3=CC=CC=C3C

Isomeric SMILES

CCN(CCNC(=O)C1CCN(CC1)S(=O)(=O)/C=C/C2=CC=CC=C2)C3=CC=CC=C3C

InChI

InChI=1S/C25H33N3O3S/c1-3-27(24-12-8-7-9-21(24)2)19-16-26-25(29)23-13-17-28(18-14-23)32(30,31)20-15-22-10-5-4-6-11-22/h4-12,15,20,23H,3,13-14,16-19H2,1-2H3,(H,26,29)/b20-15+