tert-butyl 4-[[2-(7-cyanonaphthalen-2-yl)-1-ethylsulfonyl-2,3-dihydroindol-5-yl]-methyl-amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-(7-cyanonaphthalen-2-yl)-1-ethylsulfonyl-2,3-dihydroindol-5-yl]-methyl-amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[2-(7-cyano-2-naphthyl)-1-ethylsulfonyl-indolin-5-yl]-methyl-amino]piperidine-1-carboxylate CAS Name: 4-[[2-(7-cyano-2-naphthalenyl)-1-ethylsulfonyl-2,3-dihydroindol-5-yl]-methylamino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-(7-cyanonaphthalen-2-yl)-1-ethylsulfonyl-2,3-dihydroindol-5-yl]-methylamino]piperidine-1-carboxylate Traditional Name: 4-[[2-(7-cyano-2-naphthyl)-1-esyl-indolin-5-yl]-methyl-amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C32H38N4O4S MolecularWeight: 574.73352

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1C(CC2=C1C=CC(=C2)N(C)C3CCN(CC3)C(=O)OC(C)(C)C)C4=CC5=C(C=CC(=C5)C#N)C=C4

Isomeric SMILES

CCS(=O)(=O)N1C(CC2=C1C=CC(=C2)N(C)C3CCN(CC3)C(=O)OC(C)(C)C)C4=CC5=C(C=CC(=C5)C#N)C=C4

InChI

InChI=1S/C32H38N4O4S/c1-6-41(38,39)36-29-12-11-28(34(5)27-13-15-35(16-14-27)31(37)40-32(2,3)4)19-26(29)20-30(36)24-10-9-23-8-7-22(21-33)17-25(23)18-24/h7-12,17-19,27,30H,6,13-16,20H2,1-5H3