tert-butyl 4-[[(2S)-1-methoxy-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[(2S)-1-methoxy-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[(1S)-1-methoxycarbonyl-3-methylsulfanyl-propyl]amino]piperidine-1-carboxylate CAS Name: 4-[[(2S)-1-methoxy-4-(methylthio)-1-oxobutan-2-yl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[(2S)-1-methoxy-4-methylsulfanyl-1-oxobutan-2-yl]amino]piperidine-1-carboxylate Traditional Name: 4-[[(1S)-1-carbomethoxy-3-(methylthio)propyl]amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C16H30N2O4S MolecularWeight: 346.4854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)NC(CCSC)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)N[C@@H](CCSC)C(=O)OC

InChI

InChI=1S/C16H30N2O4S/c1-16(2,3)22-15(20)18-9-6-12(7-10-18)17-13(8-11-23-5)14(19)21-4/h12-13,17H,6-11H2,1-5H3/t13-/m0/s1