tert-butyl N-[(phenylmethyl)carbamothioylamino]carbamate

Systemtic Name: tert-butyl N-[(phenylmethyl)carbamothioylamino]carbamate Openeye Name: tert-butyl N-(benzylcarbamothioylamino)carbamate CAS Name: N-[[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-(benzylcarbamothioylamino)carbamate Traditional Name: N-(benzylthiocarbamoylamino)carbamic acid tert-butyl ester Formula: C13H19N3O2S MolecularWeight: 281.37386

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NNC(=S)NCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)NNC(=S)NCC1=CC=CC=C1

InChI

InChI=1S/C13H19N3O2S/c1-13(2,3)18-12(17)16-15-11(19)14-9-10-7-5-4-6-8-10/h4-8H,9H2,1-3H3,(H,16,17)(H2,14,15,19)