5-bromanyl-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide

Systemtic Name: 5-bromanyl-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide Openeye Name: 5-bromo-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(3-pyridylmethyl)thiophene-2-carboxamide CAS Name: 5-bromo-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(3-pyridinylmethyl)-2-thiophenecarboxamide IUPAC Name: 5-bromo-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(pyridin-3-ylmethyl)thiophene-2-carboxamide Traditional Name: 5-bromo-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(3-pyridylmethyl)thiophene-2-carboxamide Formula: C20H16BrN3O3S2 MolecularWeight: 490.39334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)OC)SC(=N2)N(CC3=CN=CC=C3)C(=O)C4=CC=C(S4)Br

Isomeric SMILES

COC1=C2C(=C(C=C1)OC)SC(=N2)N(CC3=CN=CC=C3)C(=O)C4=CC=C(S4)Br

InChI

InChI=1S/C20H16BrN3O3S2/c1-26-13-5-6-14(27-2)18-17(13)23-20(29-18)24(11-12-4-3-9-22-10-12)19(25)15-7-8-16(21)28-15/h3-10H,11H2,1-2H3