3-[(2-bromanylpyridin-4-yl)methoxy]-5-(5,6-dimethoxybenzimidazol-1-yl)thiophene-2-carboxamide

Systemtic Name: 3-[(2-bromanylpyridin-4-yl)methoxy]-5-(5,6-dimethoxybenzimidazol-1-yl)thiophene-2-carboxamide Openeye Name: 3-[(2-bromo-4-pyridyl)methoxy]-5-(5,6-dimethoxybenzimidazol-1-yl)thiophene-2-carboxamide CAS Name: 3-[(2-bromo-4-pyridinyl)methoxy]-5-(5,6-dimethoxy-1-benzimidazolyl)-2-thiophenecarboxamide IUPAC Name: 3-[(2-bromopyridin-4-yl)methoxy]-5-(5,6-dimethoxybenzimidazol-1-yl)thiophene-2-carboxamide Traditional Name: 3-[(2-bromo-4-pyridyl)methoxy]-5-(5,6-dimethoxybenzimidazol-1-yl)thiophene-2-carboxamide Formula: C20H17BrN4O4S MolecularWeight: 489.34238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CN2C3=CC(=C(S3)C(=O)N)OCC4=CC(=NC=C4)Br)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CN2C3=CC(=C(S3)C(=O)N)OCC4=CC(=NC=C4)Br)OC

InChI

InChI=1S/C20H17BrN4O4S/c1-27-14-6-12-13(7-15(14)28-2)25(10-24-12)18-8-16(19(30-18)20(22)26)29-9-11-3-4-23-17(21)5-11/h3-8,10H,9H2,1-2H3,(H2,22,26)