(3S)-N-(2-diethylaminoethyl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(2-diethylaminoethyl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: (3S)-N-(2-diethylaminoethyl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: (3S)-N-(2-diethylaminoethyl)-1-(2,4,6-trimethylphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: (3S)-N-(2-diethylaminoethyl)-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: (3S)-N-(2-diethylaminoethyl)-1-mesitylsulfonyl-nipecotamide Formula: C21H35N3O3S MolecularWeight: 409.5859

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1CCCN(C1)S(=O)(=O)C2=C(C=C(C=C2C)C)C

Isomeric SMILES

CCN(CC)CCNC(=O)[C@H]1CCCN(C1)S(=O)(=O)C2=C(C=C(C=C2C)C)C

InChI

InChI=1S/C21H35N3O3S/c1-6-23(7-2)12-10-22-21(25)19-9-8-11-24(15-19)28(26,27)20-17(4)13-16(3)14-18(20)5/h13-14,19H,6-12,15H2,1-5H3,(H,22,25)/t19-/m0/s1