2-methyl-4-oxidanyl-6-oxidanylidene-5-(4-prop-2-enoxyphenyl)-3a,4,7,7a-tetrahydrothieno[2,3-b]pyridine-5-carbonitrile

Systemtic Name: 2-methyl-4-oxidanyl-6-oxidanylidene-5-(4-prop-2-enoxyphenyl)-3a,4,7,7a-tetrahydrothieno[2,3-b]pyridine-5-carbonitrile Openeye Name: 5-(4-allyloxyphenyl)-4-hydroxy-2-methyl-6-oxo-3a,4,7,7a-tetrahydrothieno[2,3-b]pyridine-5-carbonitrile CAS Name: 4-hydroxy-2-methyl-6-oxo-5-(4-prop-2-enoxyphenyl)-3a,4,7,7a-tetrahydrothieno[2,3-b]pyridine-5-carbonitrile IUPAC Name: 4-hydroxy-2-methyl-6-oxo-5-(4-prop-2-enoxyphenyl)-3a,4,7,7a-tetrahydrothieno[2,3-b]pyridine-5-carbonitrile Traditional Name: 5-(4-allyloxyphenyl)-4-hydroxy-6-keto-2-methyl-3a,4,7,7a-tetrahydrothieno[2,3-b]pyridine-5-carbonitrile Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2C(C(C(=O)NC2S1)(C#N)C3=CC=C(C=C3)OCC=C)O

Isomeric SMILES

CC1=CC2C(C(C(=O)NC2S1)(C#N)C3=CC=C(C=C3)OCC=C)O

InChI

InChI=1S/C18H18N2O3S/c1-3-8-23-13-6-4-12(5-7-13)18(10-19)15(21)14-9-11(2)24-16(14)20-17(18)22/h3-7,9,14-16,21H,1,8H2,2H3,(H,20,22)