2-(1,3-benzodioxol-5-ylmethyl)-4-chloranyl-5-ethyl-6-(4-imidazol-1-ylphenoxy)pyrimidine

Systemtic Name: 2-(1,3-benzodioxol-5-ylmethyl)-4-chloranyl-5-ethyl-6-(4-imidazol-1-ylphenoxy)pyrimidine Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)-4-chloro-5-ethyl-6-(4-imidazol-1-ylphenoxy)pyrimidine CAS Name: 2-(1,3-benzodioxol-5-ylmethyl)-4-chloro-5-ethyl-6-[4-(1-imidazolyl)phenoxy]pyrimidine IUPAC Name: 2-(1,3-benzodioxol-5-ylmethyl)-4-chloro-5-ethyl-6-(4-imidazol-1-ylphenoxy)pyrimidine Traditional Name: 4-chloro-5-ethyl-6-(4-imidazol-1-ylphenoxy)-2-piperonyl-pyrimidine Formula: C23H19ClN4O3 MolecularWeight: 434.87496

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N=C1Cl)CC2=CC3=C(C=C2)OCO3)OC4=CC=C(C=C4)N5C=CN=C5

Isomeric SMILES

CCC1=C(N=C(N=C1Cl)CC2=CC3=C(C=C2)OCO3)OC4=CC=C(C=C4)N5C=CN=C5

InChI

InChI=1S/C23H19ClN4O3/c1-2-18-22(24)26-21(12-15-3-8-19-20(11-15)30-14-29-19)27-23(18)31-17-6-4-16(5-7-17)28-10-9-25-13-28/h3-11,13H,2,12,14H2,1H3