2-[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl]ethanenitrile

Systemtic Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl]ethanenitrile Openeye Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl]acetonitrile CAS Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl]acetonitrile IUPAC Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl]acetonitrile Traditional Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl]acetonitrile Formula: C24H20N4OS MolecularWeight: 412.5068

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC3=NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)N3CC#N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC3=NC4=C(C(=CS4)C5=CC=CC=C5)C(=O)N3CC#N

InChI

InChI=1S/C24H20N4OS/c25-11-13-28-21(15-27-12-10-17-6-4-5-9-19(17)14-27)26-23-22(24(28)29)20(16-30-23)18-7-2-1-3-8-18/h1-9,16H,10,12-15H2