2-(5-bromanylpyridin-2-yl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide

Systemtic Name: 2-(5-bromanylpyridin-2-yl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide Openeye Name: 2-[(5-bromo-2-pyridyl)sulfanyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide CAS Name: 2-[(5-bromo-2-pyridinyl)thio]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide IUPAC Name: 2-(5-bromopyridin-2-yl)sulfanyl-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide Traditional Name: 2-[(5-bromo-2-pyridyl)thio]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide Formula: C20H15BrN2O3S MolecularWeight: 443.3137

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CC=C3SC4=NC=C(C=C4)Br

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)C3=CC=CC=C3SC4=NC=C(C=C4)Br

InChI

InChI=1S/C20H15BrN2O3S/c21-13-5-8-19(22-12-13)27-18-4-2-1-3-15(18)20(24)23-14-6-7-16-17(11-14)26-10-9-25-16/h1-8,11-12H,9-10H2,(H,23,24)