N-[[(3,4-dimethoxyphenyl)carbonylamino]carbamothioyl]-3-(2-ethoxyethoxy)benzamide

Systemtic Name: N-[[(3,4-dimethoxyphenyl)carbonylamino]carbamothioyl]-3-(2-ethoxyethoxy)benzamide Openeye Name: N-[[(3,4-dimethoxybenzoyl)amino]carbamothioyl]-3-(2-ethoxyethoxy)benzamide CAS Name: N-[[[(3,4-dimethoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-(2-ethoxyethoxy)benzamide IUPAC Name: N-[[(3,4-dimethoxybenzoyl)amino]carbamothioyl]-3-(2-ethoxyethoxy)benzamide Traditional Name: 3-(2-ethoxyethoxy)-N-[(veratroylamino)thiocarbamoyl]benzamide Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCOCCOC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H25N3O6S/c1-4-29-10-11-30-16-7-5-6-14(12-16)19(25)22-21(31)24-23-20(26)15-8-9-17(27-2)18(13-15)28-3/h5-9,12-13H,4,10-11H2,1-3H3,(H,23,26)(H2,22,24,25,31)