methyl N-[2-(4-methylphenoxy)ethanoylcarbamothioylamino]carbamate

Systemtic Name: methyl N-[2-(4-methylphenoxy)ethanoylcarbamothioylamino]carbamate Openeye Name: methyl N-[[2-(4-methylphenoxy)acetyl]carbamothioylamino]carbamate CAS Name: N-[[[[2-(4-methylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]carbamic acid methyl ester IUPAC Name: methyl N-[[2-(4-methylphenoxy)acetyl]carbamothioylamino]carbamate Traditional Name: N-[[2-(4-methylphenoxy)acetyl]thiocarbamoylamino]carbamic acid methyl ester Formula: C12H15N3O4S MolecularWeight: 297.3302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O4S/c1-8-3-5-9(6-4-8)19-7-10(16)13-11(20)14-15-12(17)18-2/h3-6H,7H2,1-2H3,(H,15,17)(H2,13,14,16,20)