3-bromanyl-4-(2-methoxyethoxy)-N-[(3-prop-2-enoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-(2-methoxyethoxy)-N-[(3-prop-2-enoxyphenyl)carbamothioyl]benzamide Openeye Name: N-[(3-allyloxyphenyl)carbamothioyl]-3-bromo-4-(2-methoxyethoxy)benzamide CAS Name: 3-bromo-4-(2-methoxyethoxy)-N-[(3-prop-2-enoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-(2-methoxyethoxy)-N-[(3-prop-2-enoxyphenyl)carbamothioyl]benzamide Traditional Name: N-[(3-allyloxyphenyl)thiocarbamoyl]-3-bromo-4-(2-methoxyethoxy)benzamide Formula: C20H21BrN2O4S MolecularWeight: 465.36074

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCC=C)Br

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCC=C)Br

InChI

InChI=1S/C20H21BrN2O4S/c1-3-9-26-16-6-4-5-15(13-16)22-20(28)23-19(24)14-7-8-18(17(21)12-14)27-11-10-25-2/h3-8,12-13H,1,9-11H2,2H3,(H2,22,23,24,28)