5-bromanyl-N-[[2-(2,3-dimethylphenoxy)ethanoylamino]carbamothioyl]-2-methoxy-benzamide

Systemtic Name: 5-bromanyl-N-[[2-(2,3-dimethylphenoxy)ethanoylamino]carbamothioyl]-2-methoxy-benzamide Openeye Name: 5-bromo-N-[[[2-(2,3-dimethylphenoxy)acetyl]amino]carbamothioyl]-2-methoxy-benzamide CAS Name: 5-bromo-N-[[[2-(2,3-dimethylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 5-bromo-N-[[[2-(2,3-dimethylphenoxy)acetyl]amino]carbamothioyl]-2-methoxybenzamide Traditional Name: 5-bromo-N-[[[2-(2,3-dimethylphenoxy)acetyl]amino]thiocarbamoyl]-2-methoxy-benzamide Formula: C19H20BrN3O4S MolecularWeight: 466.3488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OCC(=O)NNC(=S)NC(=O)C2=C(C=CC(=C2)Br)OC)C

Isomeric SMILES

CC1=C(C(=CC=C1)OCC(=O)NNC(=S)NC(=O)C2=C(C=CC(=C2)Br)OC)C

InChI

InChI=1S/C19H20BrN3O4S/c1-11-5-4-6-15(12(11)2)27-10-17(24)22-23-19(28)21-18(25)14-9-13(20)7-8-16(14)26-3/h4-9H,10H2,1-3H3,(H,22,24)(H2,21,23,25,28)