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

Systemtic Name: 2-[(5-methyl-4-oxidanylidene-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)methyl]benzenecarbonitrile Openeye Name: 2-[(5-methyl-4-oxo-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)methyl]benzonitrile CAS Name: 2-[(5-methyl-4-oxo-6-phenyl-3-thieno[2,3-d]pyrimidinyl)methyl]benzonitrile IUPAC Name: 2-[(5-methyl-4-oxo-6-phenylthieno[2,3-d]pyrimidin-3-yl)methyl]benzonitrile Traditional Name: 2-[(4-keto-5-methyl-6-phenyl-thieno[2,3-d]pyrimidin-3-yl)methyl]benzonitrile Formula: C21H15N3OS MolecularWeight: 357.4283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC=CC=C3C#N)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC=CC=C3C#N)C4=CC=CC=C4

InChI

InChI=1S/C21H15N3OS/c1-14-18-20(26-19(14)15-7-3-2-4-8-15)23-13-24(21(18)25)12-17-10-6-5-9-16(17)11-22/h2-10,13H,12H2,1H3