N-[[(3-bromanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]-3-(2-ethoxyethoxy)benzamide

Systemtic Name: N-[[(3-bromanyl-4-methoxy-phenyl)carbonylamino]carbamothioyl]-3-(2-ethoxyethoxy)benzamide Openeye Name: N-[[(3-bromo-4-methoxy-benzoyl)amino]carbamothioyl]-3-(2-ethoxyethoxy)benzamide CAS Name: N-[[[(3-bromo-4-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-(2-ethoxyethoxy)benzamide IUPAC Name: N-[[(3-bromo-4-methoxybenzoyl)amino]carbamothioyl]-3-(2-ethoxyethoxy)benzamide Traditional Name: N-[[(3-bromo-4-methoxy-benzoyl)amino]thiocarbamoyl]-3-(2-ethoxyethoxy)benzamide Formula: C20H22BrN3O5S MolecularWeight: 496.37478

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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)Br

Isomeric SMILES

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

InChI

InChI=1S/C20H22BrN3O5S/c1-3-28-9-10-29-15-6-4-5-13(11-15)18(25)22-20(30)24-23-19(26)14-7-8-17(27-2)16(21)12-14/h4-8,11-12H,3,9-10H2,1-2H3,(H,23,26)(H2,22,24,25,30)