2-tert-butyl-8-[2-(4-methoxyphenyl)ethynyl]-1H-pyrido[4,3-d]pyrimidin-4-one

Systemtic Name: 2-tert-butyl-8-[2-(4-methoxyphenyl)ethynyl]-1H-pyrido[4,3-d]pyrimidin-4-one Openeye Name: 2-tert-butyl-8-[2-(4-methoxyphenyl)ethynyl]-1H-pyrido[4,3-d]pyrimidin-4-one CAS Name: 2-tert-butyl-8-[2-(4-methoxyphenyl)ethynyl]-1H-pyrido[4,3-d]pyrimidin-4-one IUPAC Name: 2-tert-butyl-8-[2-(4-methoxyphenyl)ethynyl]-1H-pyrido[4,3-d]pyrimidin-4-one Traditional Name: 2-tert-butyl-8-[2-(4-methoxyphenyl)ethynyl]-1H-pyrido[4,3-d]pyrimidin-4-one Formula: C20H19N3O2 MolecularWeight: 333.38376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=O)C2=C(N1)C(=CN=C2)C#CC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)(C)C1=NC(=O)C2=C(N1)C(=CN=C2)C#CC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H19N3O2/c1-20(2,3)19-22-17-14(11-21-12-16(17)18(24)23-19)8-5-13-6-9-15(25-4)10-7-13/h6-7,9-12H,1-4H3,(H,22,23,24)