(2S)-N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-1-(4-methylphenyl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]-1-(p-tolylsulfonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]-1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-[2-(4-methoxyphenyl)-2-piperidino-ethyl]-1-tosyl-pyrrolidine-2-carboxamide Formula: C26H35N3O4S MolecularWeight: 485.6388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NCC(C3=CC=C(C=C3)OC)N4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)NCC(C3=CC=C(C=C3)OC)N4CCCCC4

InChI

InChI=1S/C26H35N3O4S/c1-20-8-14-23(15-9-20)34(31,32)29-18-6-7-24(29)26(30)27-19-25(28-16-4-3-5-17-28)21-10-12-22(33-2)13-11-21/h8-15,24-25H,3-7,16-19H2,1-2H3,(H,27,30)/t24-,25?/m0/s1