5-bromanyl-N-[[(3,4-dimethoxyphenyl)carbonylamino]carbamothioyl]-2-(3-methylbutoxy)benzamide

Systemtic Name: 5-bromanyl-N-[[(3,4-dimethoxyphenyl)carbonylamino]carbamothioyl]-2-(3-methylbutoxy)benzamide Openeye Name: 5-bromo-N-[[(3,4-dimethoxybenzoyl)amino]carbamothioyl]-2-isopentyloxy-benzamide CAS Name: 5-bromo-N-[[[(3,4-dimethoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-(3-methylbutoxy)benzamide IUPAC Name: 5-bromo-N-[[(3,4-dimethoxybenzoyl)amino]carbamothioyl]-2-(3-methylbutoxy)benzamide Traditional Name: 5-bromo-2-isoamoxy-N-[(veratroylamino)thiocarbamoyl]benzamide Formula: C22H26BrN3O5S MolecularWeight: 524.42794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NNC(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C22H26BrN3O5S/c1-13(2)9-10-31-17-8-6-15(23)12-16(17)21(28)24-22(32)26-25-20(27)14-5-7-18(29-3)19(11-14)30-4/h5-8,11-13H,9-10H2,1-4H3,(H,25,27)(H2,24,26,28,32)