tert-butyl N-[(3-methylphenyl)carbamothioylamino]carbamate

Systemtic Name: tert-butyl N-[(3-methylphenyl)carbamothioylamino]carbamate Openeye Name: tert-butyl N-(m-tolylcarbamothioylamino)carbamate CAS Name: N-[[(3-methylanilino)-sulfanylidenemethyl]amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3-methylphenyl)carbamothioylamino]carbamate Traditional Name: N-(m-tolylthiocarbamoylamino)carbamic acid tert-butyl ester Formula: C13H19N3O2S MolecularWeight: 281.37386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=S)NNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=S)NNC(=O)OC(C)(C)C

InChI

InChI=1S/C13H19N3O2S/c1-9-6-5-7-10(8-9)14-11(19)15-16-12(17)18-13(2,3)4/h5-8H,1-4H3,(H,16,17)(H2,14,15,19)