3-bromanyl-N-[[3-(tert-butylcarbamoyl)phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide

Systemtic Name: 3-bromanyl-N-[[3-(tert-butylcarbamoyl)phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide Openeye Name: 3-bromo-N-[[3-(tert-butylcarbamoyl)phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide CAS Name: 3-bromo-N-[[3-[(tert-butylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-4-(2-methoxyethoxy)benzamide IUPAC Name: 3-bromo-N-[[3-(tert-butylcarbamoyl)phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide Traditional Name: 3-bromo-N-[[3-(tert-butylcarbamoyl)phenyl]thiocarbamoyl]-4-(2-methoxyethoxy)benzamide Formula: C22H26BrN3O4S MolecularWeight: 508.42854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCCOC)Br

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OCCOC)Br

InChI

InChI=1S/C22H26BrN3O4S/c1-22(2,3)26-20(28)14-6-5-7-16(12-14)24-21(31)25-19(27)15-8-9-18(17(23)13-15)30-11-10-29-4/h5-9,12-13H,10-11H2,1-4H3,(H,26,28)(H2,24,25,27,31)