2-[4,5-bis(1,3-benzodioxol-5-yl)-1H-imidazol-2-yl]pyrimidine

Systemtic Name: 2-[4,5-bis(1,3-benzodioxol-5-yl)-1H-imidazol-2-yl]pyrimidine Openeye Name: 2-[4,5-bis(1,3-benzodioxol-5-yl)-1H-imidazol-2-yl]pyrimidine CAS Name: 2-[4,5-bis(1,3-benzodioxol-5-yl)-1H-imidazol-2-yl]pyrimidine IUPAC Name: 2-[4,5-bis(1,3-benzodioxol-5-yl)-1H-imidazol-2-yl]pyrimidine Traditional Name: 2-[4,5-bis(1,3-benzodioxol-5-yl)-1H-imidazol-2-yl]pyrimidine Formula: C21H14N4O4 MolecularWeight: 386.36026

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=C(N=C(N3)C4=NC=CC=N4)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=C(N=C(N3)C4=NC=CC=N4)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C21H14N4O4/c1-6-22-20(23-7-1)21-24-18(12-2-4-14-16(8-12)28-10-26-14)19(25-21)13-3-5-15-17(9-13)29-11-27-15/h1-9H,10-11H2,(H,24,25)