N-[6-(benzimidazol-1-yl)pyridin-3-yl]-5-chloranyl-2,3-dihydro-1,4-benzodioxine-7-carboxamide

Systemtic Name: N-[6-(benzimidazol-1-yl)pyridin-3-yl]-5-chloranyl-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-[6-(benzimidazol-1-yl)-3-pyridyl]-5-chloro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-[6-(1-benzimidazolyl)-3-pyridinyl]-5-chloro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-[6-(benzimidazol-1-yl)pyridin-3-yl]-5-chloro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-[6-(benzimidazol-1-yl)-3-pyridyl]-5-chloro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C21H15ClN4O3 MolecularWeight: 406.8218

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C=C2Cl)C(=O)NC3=CN=C(C=C3)N4C=NC5=CC=CC=C54

Isomeric SMILES

C1COC2=C(O1)C=C(C=C2Cl)C(=O)NC3=CN=C(C=C3)N4C=NC5=CC=CC=C54

InChI

InChI=1S/C21H15ClN4O3/c22-15-9-13(10-18-20(15)29-8-7-28-18)21(27)25-14-5-6-19(23-11-14)26-12-24-16-3-1-2-4-17(16)26/h1-6,9-12H,7-8H2,(H,25,27)