3-[2-(3,5-dimethylphenoxy)ethanoylcarbamothioylamino]-4-methyl-benzoate

Systemtic Name: 3-[2-(3,5-dimethylphenoxy)ethanoylcarbamothioylamino]-4-methyl-benzoate Openeye Name: 3-[[2-(3,5-dimethylphenoxy)acetyl]carbamothioylamino]-4-methyl-benzoate CAS Name: 3-[[[[2-(3,5-dimethylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]-4-methylbenzoate IUPAC Name: 3-[[2-(3,5-dimethylphenoxy)acetyl]carbamothioylamino]-4-methylbenzoate Traditional Name: 3-[[2-(3,5-dimethylphenoxy)acetyl]thiocarbamoylamino]-4-methyl-benzoate Formula: C19H19N2O4S- MolecularWeight: 371.43016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)[O-])NC(=S)NC(=O)COC2=CC(=CC(=C2)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)[O-])NC(=S)NC(=O)COC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C19H20N2O4S/c1-11-6-12(2)8-15(7-11)25-10-17(22)21-19(26)20-16-9-14(18(23)24)5-4-13(16)3/h4-9H,10H2,1-3H3,(H,23,24)(H2,20,21,22,26)/p-1