2-[5-(4-ethylphenyl)-2-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanenitrile

Systemtic Name: 2-[5-(4-ethylphenyl)-2-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanenitrile Openeye Name: 2-[5-(4-ethylphenyl)-2-methyl-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetonitrile CAS Name: 2-[5-(4-ethylphenyl)-2-methyl-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetonitrile IUPAC Name: 2-[5-(4-ethylphenyl)-2-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl]acetonitrile Traditional Name: 2-[5-(4-ethylphenyl)-4-keto-2-methyl-thieno[2,3-d]pyrimidin-3-yl]acetonitrile Formula: C17H15N3OS MolecularWeight: 309.3855

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)C)CC#N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)C)CC#N

InChI

InChI=1S/C17H15N3OS/c1-3-12-4-6-13(7-5-12)14-10-22-16-15(14)17(21)20(9-8-18)11(2)19-16/h4-7,10H,3,9H2,1-2H3