5-(1,3-benzodioxol-5-yl)-7-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-7-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine Openeye Name: 5-(1,3-benzodioxol-5-yl)-7-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine CAS Name: 5-(1,3-benzodioxol-5-yl)-7-(4-methoxyphenyl)-4-pyrido[2,3-d]pyrimidinamine IUPAC Name: 5-(1,3-benzodioxol-5-yl)-7-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-amine Traditional Name: [5-(1,3-benzodioxol-5-yl)-7-(4-methoxyphenyl)pyrido[2,3-d]pyrimidin-4-yl]amine Formula: C21H16N4O3 MolecularWeight: 372.37674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=C(C(=C2)C4=CC5=C(C=C4)OCO5)C(=NC=N3)N

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=C(C(=C2)C4=CC5=C(C=C4)OCO5)C(=NC=N3)N

InChI

InChI=1S/C21H16N4O3/c1-26-14-5-2-12(3-6-14)16-9-15(19-20(22)23-10-24-21(19)25-16)13-4-7-17-18(8-13)28-11-27-17/h2-10H,11H2,1H3,(H2,22,23,24,25)