tert-butyl N-[(phenylmethyl)carbamothioyl-propyl-amino]carbamate

Systemtic Name: tert-butyl N-[(phenylmethyl)carbamothioyl-propyl-amino]carbamate Openeye Name: tert-butyl N-[benzylcarbamothioyl(propyl)amino]carbamate CAS Name: N-[[[(phenylmethyl)amino]-sulfanylidenemethyl]-propylamino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[benzylcarbamothioyl(propyl)amino]carbamate Traditional Name: N-[benzylthiocarbamoyl(propyl)amino]carbamic acid tert-butyl ester Formula: C16H25N3O2S MolecularWeight: 323.4536

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(=S)NCC1=CC=CC=C1)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCN(C(=S)NCC1=CC=CC=C1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C16H25N3O2S/c1-5-11-19(18-15(20)21-16(2,3)4)14(22)17-12-13-9-7-6-8-10-13/h6-10H,5,11-12H2,1-4H3,(H,17,22)(H,18,20)