4-(3a,4-dihydro-1,3-benzodioxol-5-yl)-N-[(4-ethynylphenyl)methyl]-5-(6-methylpyridin-2-yl)-1H-imidazol-2-amine

Systemtic Name: 4-(3a,4-dihydro-1,3-benzodioxol-5-yl)-N-[(4-ethynylphenyl)methyl]-5-(6-methylpyridin-2-yl)-1H-imidazol-2-amine Openeye Name: 4-(3a,4-dihydro-1,3-benzodioxol-5-yl)-N-[(4-ethynylphenyl)methyl]-5-(6-methyl-2-pyridyl)-1H-imidazol-2-amine CAS Name: 4-(3a,4-dihydro-1,3-benzodioxol-5-yl)-N-[(4-ethynylphenyl)methyl]-5-(6-methyl-2-pyridinyl)-1H-imidazol-2-amine IUPAC Name: 4-(3a,4-dihydro-1,3-benzodioxol-5-yl)-N-[(4-ethynylphenyl)methyl]-5-(6-methylpyridin-2-yl)-1H-imidazol-2-amine Traditional Name: [4-(3a,4-dihydro-1,3-benzodioxol-5-yl)-5-(6-methyl-2-pyridyl)-1H-imidazol-2-yl]-(4-ethynylbenzyl)amine Formula: C25H22N4O2 MolecularWeight: 410.46778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=N1)C2=C(N=C(N2)NCC3=CC=C(C=C3)C#C)C4=CC=C5C(C4)OCO5

Isomeric SMILES

CC1=CC=CC(=N1)C2=C(N=C(N2)NCC3=CC=C(C=C3)C#C)C4=CC=C5C(C4)OCO5

InChI

InChI=1S/C25H22N4O2/c1-3-17-7-9-18(10-8-17)14-26-25-28-23(19-11-12-21-22(13-19)31-15-30-21)24(29-25)20-6-4-5-16(2)27-20/h1,4-12,22H,13-15H2,2H3,(H2,26,28,29)