N-(1,3-benzodioxol-5-ylmethyl)-2-(3-methoxyphenyl)-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-methoxyphenyl)-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-methoxyphenyl)-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-methoxyphenyl)-5-phenyl-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-methoxyphenyl)-5-phenylpyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: [2-(3-methoxyphenyl)-5-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl]-piperonyl-amine Formula: C27H22N4O3 MolecularWeight: 450.48858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NN3C(=C2)N=C(C=C3NCC4=CC5=C(C=C4)OCO5)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=CC(=C1)C2=NN3C(=C2)N=C(C=C3NCC4=CC5=C(C=C4)OCO5)C6=CC=CC=C6

InChI

InChI=1S/C27H22N4O3/c1-32-21-9-5-8-20(13-21)23-15-27-29-22(19-6-3-2-4-7-19)14-26(31(27)30-23)28-16-18-10-11-24-25(12-18)34-17-33-24/h2-15,28H,16-17H2,1H3