3-bromanyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)-4-methoxy-benzamide

Systemtic Name: 3-bromanyl-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)-4-methoxy-benzamide Openeye Name: 3-bromo-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)-4-methoxy-benzamide CAS Name: 3-bromo-N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)-4-methoxybenzamide Traditional Name: 3-bromo-N-(2,3-dihydro-1,4-benzodioxin-6-ylthiocarbamoyl)-4-methoxy-benzamide Formula: C17H15BrN2O4S MolecularWeight: 423.281

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OCCO3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC3=C(C=C2)OCCO3)Br

InChI

InChI=1S/C17H15BrN2O4S/c1-22-13-4-2-10(8-12(13)18)16(21)20-17(25)19-11-3-5-14-15(9-11)24-7-6-23-14/h2-5,8-9H,6-7H2,1H3,(H2,19,20,21,25)