2-[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-3-propyl-phenyl]-1,4,5,6-tetrahydropyrimidine

Systemtic Name: 2-[2-[2-(5-bromanyl-2-methoxy-phenyl)ethyl]-3-propyl-phenyl]-1,4,5,6-tetrahydropyrimidine Openeye Name: 2-[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-3-propyl-phenyl]-1,4,5,6-tetrahydropyrimidine CAS Name: 2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-propylphenyl]-1,4,5,6-tetrahydropyrimidine IUPAC Name: 2-[2-[2-(5-bromo-2-methoxyphenyl)ethyl]-3-propylphenyl]-1,4,5,6-tetrahydropyrimidine Traditional Name: 2-[2-[2-(5-bromo-2-methoxy-phenyl)ethyl]-3-propyl-phenyl]-1,4,5,6-tetrahydropyrimidine Formula: C22H27BrN2O MolecularWeight: 415.36658

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC(=C1CCC2=C(C=CC(=C2)Br)OC)C3=NCCCN3

Isomeric SMILES

CCCC1=CC=CC(=C1CCC2=C(C=CC(=C2)Br)OC)C3=NCCCN3

InChI

InChI=1S/C22H27BrN2O/c1-3-6-16-7-4-8-20(22-24-13-5-14-25-22)19(16)11-9-17-15-18(23)10-12-21(17)26-2/h4,7-8,10,12,15H,3,5-6,9,11,13-14H2,1-2H3,(H,24,25)