methyl N-[(4-propan-2-ylphenyl)carbonylcarbamothioylamino]carbamate

Systemtic Name: methyl N-[(4-propan-2-ylphenyl)carbonylcarbamothioylamino]carbamate Openeye Name: methyl N-[(4-isopropylbenzoyl)carbamothioylamino]carbamate CAS Name: N-[[[[oxo-(4-propan-2-ylphenyl)methyl]amino]-sulfanylidenemethyl]amino]carbamic acid methyl ester IUPAC Name: methyl N-[(4-propan-2-ylbenzoyl)carbamothioylamino]carbamate Traditional Name: N-(cumoylthiocarbamoylamino)carbamic acid methyl ester Formula: C13H17N3O3S MolecularWeight: 295.35738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17N3O3S/c1-8(2)9-4-6-10(7-5-9)11(17)14-12(20)15-16-13(18)19-3/h4-8H,1-3H3,(H,16,18)(H2,14,15,17,20)