methyl N-(2-phenylethanoylcarbamothioylamino)carbamate

Systemtic Name: methyl N-(2-phenylethanoylcarbamothioylamino)carbamate Openeye Name: methyl N-[(2-phenylacetyl)carbamothioylamino]carbamate CAS Name: N-[[[(1-oxo-2-phenylethyl)amino]-sulfanylidenemethyl]amino]carbamic acid methyl ester IUPAC Name: methyl N-[(2-phenylacetyl)carbamothioylamino]carbamate Traditional Name: N-[(2-phenylacetyl)thiocarbamoylamino]carbamic acid methyl ester Formula: C11H13N3O3S MolecularWeight: 267.30422

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NNC(=S)NC(=O)CC1=CC=CC=C1

Isomeric SMILES

COC(=O)NNC(=S)NC(=O)CC1=CC=CC=C1

InChI

InChI=1S/C11H13N3O3S/c1-17-11(16)14-13-10(18)12-9(15)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H,14,16)(H2,12,13,15,18)