tert-butyl 4-[(3-methylbutylcarbamothioylamino)carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(3-methylbutylcarbamothioylamino)carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(isopentylcarbamothioylamino)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[[(3-methylbutylamino)-sulfanylidenemethyl]hydrazo]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(3-methylbutylcarbamothioylamino)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(isoamylthiocarbamoylamino)carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C17H32N4O3S MolecularWeight: 372.52598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)C1CCN(CC1)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)C1CCN(CC1)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H32N4O3S/c1-12(2)6-9-18-15(25)20-19-14(22)13-7-10-21(11-8-13)16(23)24-17(3,4)5/h12-13H,6-11H2,1-5H3,(H,19,22)(H2,18,20,25)