2-[2-(5-bromanyl-2-methoxy-phenyl)-6-(4-ethylphenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]-6-ethoxy-phenol

Systemtic Name: 2-[2-(5-bromanyl-2-methoxy-phenyl)-6-(4-ethylphenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]-6-ethoxy-phenol Openeye Name: 2-[2-(5-bromo-2-methoxy-phenyl)-6-(4-ethylphenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]-6-ethoxy-phenol CAS Name: 2-[2-(5-bromo-2-methoxyphenyl)-6-(4-ethylphenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]-6-ethoxyphenol IUPAC Name: 2-[2-(5-bromo-2-methoxyphenyl)-6-(4-ethylphenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]-6-ethoxyphenol Traditional Name: 2-[2-(5-bromo-2-methoxy-phenyl)-6-(4-ethylphenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]-6-ethoxy-phenol Formula: C27H29BrN2O3 MolecularWeight: 509.43476

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CC(NC(N2)C3=C(C=CC(=C3)Br)OC)C4=C(C(=CC=C4)OCC)O

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CC(NC(N2)C3=C(C=CC(=C3)Br)OC)C4=C(C(=CC=C4)OCC)O

InChI

InChI=1S/C27H29BrN2O3/c1-4-17-9-11-18(12-10-17)22-16-23(20-7-6-8-25(26(20)31)33-5-2)30-27(29-22)21-15-19(28)13-14-24(21)32-3/h6-16,23,27,29-31H,4-5H2,1-3H3