N-(3-ethynylphenyl)-6-methyl-pyrido[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(3-ethynylphenyl)-6-methyl-pyrido[3,4-d]pyrimidin-4-amine Openeye Name: N-(3-ethynylphenyl)-6-methyl-pyrido[3,4-d]pyrimidin-4-amine CAS Name: N-(3-ethynylphenyl)-6-methyl-4-pyrido[3,4-d]pyrimidinamine IUPAC Name: N-(3-ethynylphenyl)-6-methylpyrido[3,4-d]pyrimidin-4-amine Traditional Name: (3-ethynylphenyl)-(6-methylpyrido[3,4-d]pyrimidin-4-yl)amine Formula: C16H12N4 MolecularWeight: 260.29328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2C(=C1)C(=NC=N2)NC3=CC=CC(=C3)C#C

Isomeric SMILES

CC1=NC=C2C(=C1)C(=NC=N2)NC3=CC=CC(=C3)C#C

InChI

InChI=1S/C16H12N4/c1-3-12-5-4-6-13(8-12)20-16-14-7-11(2)17-9-15(14)18-10-19-16/h1,4-10H,2H3,(H,18,19,20)