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

Systemtic Name: 3-[(Z)-2-chloranyl-2-(6-methyl-4-oxidanylidene-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)ethenyl]benzenecarbonitrile Openeye Name: 3-[(Z)-2-chloro-2-(6-methyl-4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)vinyl]benzonitrile CAS Name: 3-[(Z)-2-chloro-2-(6-methyl-4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)ethenyl]benzonitrile IUPAC Name: 3-[(Z)-2-chloro-2-(6-methyl-4-oxo-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)ethenyl]benzonitrile Traditional Name: 3-[(Z)-2-chloro-2-(4-keto-6-methyl-5-phenyl-3H-thieno[2,3-d]pyrimidin-2-yl)vinyl]benzonitrile Formula: C22H14ClN3OS MolecularWeight: 403.88406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(NC2=O)C(=CC3=CC=CC(=C3)C#N)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(S1)N=C(NC2=O)/C(=C/C3=CC=CC(=C3)C#N)/Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H14ClN3OS/c1-13-18(16-8-3-2-4-9-16)19-21(27)25-20(26-22(19)28-13)17(23)11-14-6-5-7-15(10-14)12-24/h2-11H,1H3,(H,25,26,27)/b17-11-