tert-butyl 1-(cyclohexylcarbamothioyl)pyrrolidine-2-carboxylate

Systemtic Name: tert-butyl 1-(cyclohexylcarbamothioyl)pyrrolidine-2-carboxylate Openeye Name: tert-butyl 1-(cyclohexylcarbamothioyl)pyrrolidine-2-carboxylate CAS Name: 1-[(cyclohexylamino)-sulfanylidenemethyl]-2-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-(cyclohexylcarbamothioyl)pyrrolidine-2-carboxylate Traditional Name: 1-(cyclohexylthiocarbamoyl)pyrrolidine-2-carboxylic acid tert-butyl ester Formula: C16H28N2O2S MolecularWeight: 312.47072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCCN1C(=S)NC2CCCCC2

Isomeric SMILES

CC(C)(C)OC(=O)C1CCCN1C(=S)NC2CCCCC2

InChI

InChI=1S/C16H28N2O2S/c1-16(2,3)20-14(19)13-10-7-11-18(13)15(21)17-12-8-5-4-6-9-12/h12-13H,4-11H2,1-3H3,(H,17,21)