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

Systemtic Name: 3-bromanyl-N-[(2,5-dimethoxyphenyl)carbamothioyl]-4-ethoxy-benzamide Openeye Name: 3-bromo-N-[(2,5-dimethoxyphenyl)carbamothioyl]-4-ethoxy-benzamide CAS Name: 3-bromo-N-[(2,5-dimethoxyanilino)-sulfanylidenemethyl]-4-ethoxybenzamide IUPAC Name: 3-bromo-N-[(2,5-dimethoxyphenyl)carbamothioyl]-4-ethoxybenzamide Traditional Name: 3-bromo-N-[(2,5-dimethoxyphenyl)thiocarbamoyl]-4-ethoxy-benzamide Formula: C18H19BrN2O4S MolecularWeight: 439.32346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)OC)OC)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)OC)OC)Br

InChI

InChI=1S/C18H19BrN2O4S/c1-4-25-15-7-5-11(9-13(15)19)17(22)21-18(26)20-14-10-12(23-2)6-8-16(14)24-3/h5-10H,4H2,1-3H3,(H2,20,21,22,26)