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

Systemtic Name: 5-bromanyl-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)thiophene-2-carboxamide Openeye Name: N-benzyl-5-bromo-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)thiophene-2-carboxamide CAS Name: 5-bromo-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-2-thiophenecarboxamide IUPAC Name: N-benzyl-5-bromo-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Traditional Name: N-benzyl-5-bromo-N-(4,7-dimethoxy-1,3-benzothiazol-2-yl)thiophene-2-carboxamide Formula: C21H17BrN2O3S2 MolecularWeight: 489.40528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17BrN2O3S2/c1-26-14-8-9-15(27-2)19-18(14)23-21(29-19)24(12-13-6-4-3-5-7-13)20(25)16-10-11-17(22)28-16/h3-11H,12H2,1-2H3