2-[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-3-chloranyl-phenyl]-1-ethyl-5,6-dihydro-4H-pyrimidine

Systemtic Name: 2-[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-3-chloranyl-phenyl]-1-ethyl-5,6-dihydro-4H-pyrimidine Openeye Name: 2-[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-3-chloro-phenyl]-1-ethyl-5,6-dihydro-4H-pyrimidine CAS Name: 2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-chlorophenyl]-1-ethyl-5,6-dihydro-4H-pyrimidine IUPAC Name: 2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-chlorophenyl]-1-ethyl-5,6-dihydro-4H-pyrimidine Traditional Name: 2-[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-3-chloro-phenyl]-1-ethyl-5,6-dihydro-4H-pyrimidine Formula: C21H24BrClN2O MolecularWeight: 435.78506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCN=C1C2=C(C(=CC=C2)Cl)CCC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CCN1CCCN=C1C2=C(C(=CC=C2)Cl)CCC3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C21H24BrClN2O/c1-3-25-13-5-12-24-21(25)18-6-4-7-19(23)17(18)10-8-15-14-16(22)9-11-20(15)26-2/h4,6-7,9,11,14H,3,5,8,10,12-13H2,1-2H3