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

Systemtic Name: 3-[(6-ethyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl)methyl]benzenecarbonitrile Openeye Name: 3-[(6-ethyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl)methyl]benzonitrile CAS Name: 3-[(6-ethyl-4-oxo-3-thieno[2,3-d]pyrimidinyl)methyl]benzonitrile IUPAC Name: 3-[(6-ethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)methyl]benzonitrile Traditional Name: 3-[(6-ethyl-4-keto-thieno[2,3-d]pyrimidin-3-yl)methyl]benzonitrile Formula: C16H13N3OS MolecularWeight: 295.35892

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=CN(C2=O)CC3=CC=CC(=C3)C#N

Isomeric SMILES

CCC1=CC2=C(S1)N=CN(C2=O)CC3=CC=CC(=C3)C#N

InChI

InChI=1S/C16H13N3OS/c1-2-13-7-14-15(21-13)18-10-19(16(14)20)9-12-5-3-4-11(6-12)8-17/h3-7,10H,2,9H2,1H3