tert-butyl 4-[methyl-[(4-methylsulfanylphenyl)methyl]carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[methyl-[(4-methylsulfanylphenyl)methyl]carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[methyl-[(4-methylsulfanylphenyl)methyl]carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[methyl-[[4-(methylthio)phenyl]methyl]amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[methyl-[(4-methylsulfanylphenyl)methyl]carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[methyl-[4-(methylthio)benzyl]carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H30N2O3S MolecularWeight: 378.5288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N(C)CC2=CC=C(C=C2)SC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N(C)CC2=CC=C(C=C2)SC

InChI

InChI=1S/C20H30N2O3S/c1-20(2,3)25-19(24)22-12-10-16(11-13-22)18(23)21(4)14-15-6-8-17(26-5)9-7-15/h6-9,16H,10-14H2,1-5H3