3-(2-chlorophenyl)-N-[[(3,4,5-trimethoxyphenyl)carbonylamino]carbamothioyl]propanamide

Systemtic Name: 3-(2-chlorophenyl)-N-[[(3,4,5-trimethoxyphenyl)carbonylamino]carbamothioyl]propanamide Openeye Name: 3-(2-chlorophenyl)-N-[[(3,4,5-trimethoxybenzoyl)amino]carbamothioyl]propanamide CAS Name: 3-(2-chlorophenyl)-N-[[[oxo-(3,4,5-trimethoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]propanamide IUPAC Name: 3-(2-chlorophenyl)-N-[[(3,4,5-trimethoxybenzoyl)amino]carbamothioyl]propanamide Traditional Name: 3-(2-chlorophenyl)-N-[[(3,4,5-trimethoxybenzoyl)amino]thiocarbamoyl]propionamide Formula: C20H22ClN3O5S MolecularWeight: 451.92378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NNC(=S)NC(=O)CCC2=CC=CC=C2Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NNC(=S)NC(=O)CCC2=CC=CC=C2Cl

InChI

InChI=1S/C20H22ClN3O5S/c1-27-15-10-13(11-16(28-2)18(15)29-3)19(26)23-24-20(30)22-17(25)9-8-12-6-4-5-7-14(12)21/h4-7,10-11H,8-9H2,1-3H3,(H,23,26)(H2,22,24,25,30)