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

Systemtic Name: 3-bromanyl-N-[[2-(2-ethoxyethoxy)phenyl]carbamothioyl]-4-propan-2-yloxy-benzamide Openeye Name: 3-bromo-N-[[2-(2-ethoxyethoxy)phenyl]carbamothioyl]-4-isopropoxy-benzamide CAS Name: 3-bromo-N-[[2-(2-ethoxyethoxy)anilino]-sulfanylidenemethyl]-4-propan-2-yloxybenzamide IUPAC Name: 3-bromo-N-[[2-(2-ethoxyethoxy)phenyl]carbamothioyl]-4-propan-2-yloxybenzamide Traditional Name: 3-bromo-N-[[2-(2-ethoxyethoxy)phenyl]thiocarbamoyl]-4-isopropoxy-benzamide Formula: C21H25BrN2O4S MolecularWeight: 481.4032

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=CC=CC=C1NC(=S)NC(=O)C2=CC(=C(C=C2)OC(C)C)Br

Isomeric SMILES

CCOCCOC1=CC=CC=C1NC(=S)NC(=O)C2=CC(=C(C=C2)OC(C)C)Br

InChI

InChI=1S/C21H25BrN2O4S/c1-4-26-11-12-27-19-8-6-5-7-17(19)23-21(29)24-20(25)15-9-10-18(16(22)13-15)28-14(2)3/h5-10,13-14H,4,11-12H2,1-3H3,(H2,23,24,25,29)