tert-butyl 4-[[2-(methylsulfanylcarbamoylamino)phenoxy]methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-(methylsulfanylcarbamoylamino)phenoxy]methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[2-(methylsulfanylcarbamoylamino)phenoxy]methyl]piperidine-1-carboxylate CAS Name: 4-[[2-[[[(methylthio)amino]-oxomethyl]amino]phenoxy]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-(methylsulfanylcarbamoylamino)phenoxy]methyl]piperidine-1-carboxylate Traditional Name: 4-[[2-[(methylthio)carbamoylamino]phenoxy]methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C19H29N3O4S MolecularWeight: 395.51626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)COC2=CC=CC=C2NC(=O)NSC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)COC2=CC=CC=C2NC(=O)NSC

InChI

InChI=1S/C19H29N3O4S/c1-19(2,3)26-18(24)22-11-9-14(10-12-22)13-25-16-8-6-5-7-15(16)20-17(23)21-27-4/h5-8,14H,9-13H2,1-4H3,(H2,20,21,23)