2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(E)-2-thiophen-2-ylethenyl]-1H-pyrido[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(E)-2-thiophen-2-ylethenyl]-1H-pyrido[2,3-d]pyrimidin-4-one Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(E)-2-(2-thienyl)vinyl]-1H-pyrido[2,3-d]pyrimidin-4-one CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(E)-2-thiophen-2-ylethenyl]-1H-pyrido[2,3-d]pyrimidin-4-one IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(E)-2-thiophen-2-ylethenyl]-1H-pyrido[2,3-d]pyrimidin-4-one Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-5-[(E)-2-(2-thienyl)vinyl]-1H-pyrido[2,3-d]pyrimidin-4-one Formula: C22H18N4OS MolecularWeight: 386.46952

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=NC(=O)C4=C(C=CN=C4N3)C=CC5=CC=CS5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=NC(=O)C4=C(C=CN=C4N3)/C=C/C5=CC=CS5

InChI

InChI=1S/C22H18N4OS/c27-21-19-16(7-8-18-6-3-13-28-18)9-11-23-20(19)24-22(25-21)26-12-10-15-4-1-2-5-17(15)14-26/h1-9,11,13H,10,12,14H2,(H,23,24,25,27)/b8-7+