methyl 4-[[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]carbamothioylamino]benzoate

Systemtic Name: methyl 4-[[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]carbamothioylamino]benzoate Openeye Name: methyl 4-[[(E)-(3,4,5-trimethoxyphenyl)methyleneamino]carbamothioylamino]benzoate CAS Name: 4-[[sulfanylidene-[(2E)-2-[(3,4,5-trimethoxyphenyl)methylidene]hydrazinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]carbamothioylamino]benzoate Traditional Name: 4-[[(E)-(3,4,5-trimethoxybenzylidene)amino]thiocarbamoylamino]benzoic acid methyl ester Formula: C19H21N3O5S MolecularWeight: 403.45214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=NNC(=S)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=N/NC(=S)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H21N3O5S/c1-24-15-9-12(10-16(25-2)17(15)26-3)11-20-22-19(28)21-14-7-5-13(6-8-14)18(23)27-4/h5-11H,1-4H3,(H2,21,22,28)/b20-11+