tert-butyl 4-(aminomethyl)-4-phenylsulfanyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(aminomethyl)-4-phenylsulfanyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-(aminomethyl)-4-phenylsulfanyl-piperidine-1-carboxylate CAS Name: 4-(aminomethyl)-4-(phenylthio)-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(aminomethyl)-4-phenylsulfanylpiperidine-1-carboxylate Traditional Name: 4-(aminomethyl)-4-(phenylthio)piperidine-1-carboxylic acid tert-butyl ester Formula: C17H26N2O2S MolecularWeight: 322.46554

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)(CN)SC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)(CN)SC2=CC=CC=C2

InChI

InChI=1S/C17H26N2O2S/c1-16(2,3)21-15(20)19-11-9-17(13-18,10-12-19)22-14-7-5-4-6-8-14/h4-8H,9-13,18H2,1-3H3