methyl 2-[(1-methoxy-3-methyl-1-oxidanylidene-butan-2-yl)carbamothioylamino]benzoate

Systemtic Name: methyl 2-[(1-methoxy-3-methyl-1-oxidanylidene-butan-2-yl)carbamothioylamino]benzoate Openeye Name: methyl 2-[(1-methoxycarbonyl-2-methyl-propyl)carbamothioylamino]benzoate CAS Name: 2-[[[(1-methoxy-3-methyl-1-oxobutan-2-yl)amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(1-methoxy-3-methyl-1-oxobutan-2-yl)carbamothioylamino]benzoate Traditional Name: 2-[(1-carbomethoxy-2-methyl-propyl)thiocarbamoylamino]benzoic acid methyl ester Formula: C15H20N2O4S MolecularWeight: 324.3953

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=S)NC1=CC=CC=C1C(=O)OC

Isomeric SMILES

CC(C)C(C(=O)OC)NC(=S)NC1=CC=CC=C1C(=O)OC

InChI

InChI=1S/C15H20N2O4S/c1-9(2)12(14(19)21-4)17-15(22)16-11-8-6-5-7-10(11)13(18)20-3/h5-9,12H,1-4H3,(H2,16,17,22)