2-bromanyl-6-oxidanyl-4-oxidanylidene-3-(4-prop-2-enoxyphenyl)-7H-thieno[2,3-b]pyridine-5-carbonitrile

Systemtic Name: 2-bromanyl-6-oxidanyl-4-oxidanylidene-3-(4-prop-2-enoxyphenyl)-7H-thieno[2,3-b]pyridine-5-carbonitrile Openeye Name: 3-(4-allyloxyphenyl)-2-bromo-6-hydroxy-4-oxo-7H-thieno[2,3-b]pyridine-5-carbonitrile CAS Name: 2-bromo-6-hydroxy-4-oxo-3-(4-prop-2-enoxyphenyl)-7H-thieno[2,3-b]pyridine-5-carbonitrile IUPAC Name: 2-bromo-6-hydroxy-4-oxo-3-(4-prop-2-enoxyphenyl)-7H-thieno[2,3-b]pyridine-5-carbonitrile Traditional Name: 3-(4-allyloxyphenyl)-2-bromo-6-hydroxy-4-keto-7H-thieno[2,3-b]pyridine-5-carbonitrile Formula: C17H11BrN2O3S MolecularWeight: 403.24984

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)C2=C(SC3=C2C(=O)C(=C(N3)O)C#N)Br

Isomeric SMILES

C=CCOC1=CC=C(C=C1)C2=C(SC3=C2C(=O)C(=C(N3)O)C#N)Br

InChI

InChI=1S/C17H11BrN2O3S/c1-2-7-23-10-5-3-9(4-6-10)12-13-14(21)11(8-19)16(22)20-17(13)24-15(12)18/h2-6H,1,7H2,(H2,20,21,22)