5-bromanyl-2-ethoxy-N-[[3-(2-methoxyethoxy)phenyl]carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-ethoxy-N-[[3-(2-methoxyethoxy)phenyl]carbamothioyl]benzamide Openeye Name: 5-bromo-2-ethoxy-N-[[3-(2-methoxyethoxy)phenyl]carbamothioyl]benzamide CAS Name: 5-bromo-2-ethoxy-N-[[3-(2-methoxyethoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-ethoxy-N-[[3-(2-methoxyethoxy)phenyl]carbamothioyl]benzamide Traditional Name: 5-bromo-2-ethoxy-N-[[3-(2-methoxyethoxy)phenyl]thiocarbamoyl]benzamide Formula: C19H21BrN2O4S MolecularWeight: 453.35004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrN2O4S/c1-3-25-17-8-7-13(20)11-16(17)18(23)22-19(27)21-14-5-4-6-15(12-14)26-10-9-24-2/h4-8,11-12H,3,9-10H2,1-2H3,(H2,21,22,23,27)