3-bromanyl-N-[[3-(2-methoxyethylcarbamoyl)phenyl]carbamothioyl]-4-propan-2-yloxy-benzamide

Systemtic Name: 3-bromanyl-N-[[3-(2-methoxyethylcarbamoyl)phenyl]carbamothioyl]-4-propan-2-yloxy-benzamide Openeye Name: 3-bromo-4-isopropoxy-N-[[3-(2-methoxyethylcarbamoyl)phenyl]carbamothioyl]benzamide CAS Name: 3-bromo-N-[[3-[(2-methoxyethylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-4-propan-2-yloxybenzamide IUPAC Name: 3-bromo-N-[[3-(2-methoxyethylcarbamoyl)phenyl]carbamothioyl]-4-propan-2-yloxybenzamide Traditional Name: 3-bromo-4-isopropoxy-N-[[3-(2-methoxyethylcarbamoyl)phenyl]thiocarbamoyl]benzamide Formula: C21H24BrN3O4S MolecularWeight: 494.40196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCCOC)Br

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCCOC)Br

InChI

InChI=1S/C21H24BrN3O4S/c1-13(2)29-18-8-7-15(12-17(18)22)20(27)25-21(30)24-16-6-4-5-14(11-16)19(26)23-9-10-28-3/h4-8,11-13H,9-10H2,1-3H3,(H,23,26)(H2,24,25,27,30)