2-[[4-(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)-2-ethoxy-phenoxy]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)-2-ethoxy-phenoxy]methyl]benzenecarbonitrile Openeye Name: 2-[[4-(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)-2-ethoxy-phenoxy]methyl]benzonitrile CAS Name: 2-[[4-(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)-2-ethoxyphenoxy]methyl]benzonitrile IUPAC Name: 2-[[4-(5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)-2-ethoxyphenoxy]methyl]benzonitrile Traditional Name: 2-[[2-ethoxy-4-(4-keto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-2-yl)phenoxy]methyl]benzonitrile Formula: C24H21N3O3S MolecularWeight: 431.50684

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C2=NC3=C(C(=C(S3)C)C)C(=O)N2)OCC4=CC=CC=C4C#N

Isomeric SMILES

CCOC1=C(C=CC(=C1)C2=NC3=C(C(=C(S3)C)C)C(=O)N2)OCC4=CC=CC=C4C#N

InChI

InChI=1S/C24H21N3O3S/c1-4-29-20-11-16(22-26-23(28)21-14(2)15(3)31-24(21)27-22)9-10-19(20)30-13-18-8-6-5-7-17(18)12-25/h5-11H,4,13H2,1-3H3,(H,26,27,28)