methyl 2-[4-[[(3,5-dimethoxyphenyl)carbonylamino]carbamothioylamino]phenyl]ethanoate

Systemtic Name: methyl 2-[4-[[(3,5-dimethoxyphenyl)carbonylamino]carbamothioylamino]phenyl]ethanoate Openeye Name: methyl 2-[4-[[(3,5-dimethoxybenzoyl)amino]carbamothioylamino]phenyl]acetate CAS Name: 2-[4-[[[[(3,5-dimethoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]amino]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[[(3,5-dimethoxybenzoyl)amino]carbamothioylamino]phenyl]acetate Traditional Name: 2-[4-[[(3,5-dimethoxybenzoyl)amino]thiocarbamoylamino]phenyl]acetic acid methyl ester Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)NNC(=S)NC2=CC=C(C=C2)CC(=O)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)NNC(=S)NC2=CC=C(C=C2)CC(=O)OC)OC

InChI

InChI=1S/C19H21N3O5S/c1-25-15-9-13(10-16(11-15)26-2)18(24)21-22-19(28)20-14-6-4-12(5-7-14)8-17(23)27-3/h4-7,9-11H,8H2,1-3H3,(H,21,24)(H2,20,22,28)