tert-butyl 4-[3-[methyl-(4-methylsulfanylphenyl)amino]propyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-[methyl-(4-methylsulfanylphenyl)amino]propyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[3-(N-methyl-4-methylsulfanyl-anilino)propyl]piperidine-1-carboxylate CAS Name: 4-[3-[N-methyl-4-(methylthio)anilino]propyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(N-methyl-4-methylsulfanylanilino)propyl]piperidine-1-carboxylate Traditional Name: 4-[3-[N-methyl-4-(methylthio)anilino]propyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H34N2O2S MolecularWeight: 378.57186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CCCN(C)C2=CC=C(C=C2)SC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CCCN(C)C2=CC=C(C=C2)SC

InChI

InChI=1S/C21H34N2O2S/c1-21(2,3)25-20(24)23-15-12-17(13-16-23)7-6-14-22(4)18-8-10-19(26-5)11-9-18/h8-11,17H,6-7,12-16H2,1-5H3