2-[[6-methyl-5-(4-methylphenyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]methoxy]benzenecarbonitrile

Systemtic Name: 2-[[6-methyl-5-(4-methylphenyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl]methoxy]benzenecarbonitrile Openeye Name: 2-[[6-methyl-4-oxo-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methoxy]benzonitrile CAS Name: 2-[[6-methyl-5-(4-methylphenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methoxy]benzonitrile IUPAC Name: 2-[[6-methyl-5-(4-methylphenyl)-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl]methoxy]benzonitrile Traditional Name: 2-[[4-keto-6-methyl-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methoxy]benzonitrile Formula: C22H17N3O2S MolecularWeight: 387.45428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)NC(=N3)COC4=CC=CC=C4C#N)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC3=C2C(=O)NC(=N3)COC4=CC=CC=C4C#N)C

InChI

InChI=1S/C22H17N3O2S/c1-13-7-9-15(10-8-13)19-14(2)28-22-20(19)21(26)24-18(25-22)12-27-17-6-4-3-5-16(17)11-23/h3-10H,12H2,1-2H3,(H,24,25,26)