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

Systemtic Name: 2-[6-(1,3-benzodioxol-5-yl)-2-(5-bromanyl-2-methoxy-phenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]phenol Openeye Name: 2-[6-(1,3-benzodioxol-5-yl)-2-(5-bromo-2-methoxy-phenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]phenol CAS Name: 2-[6-(1,3-benzodioxol-5-yl)-2-(5-bromo-2-methoxyphenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]phenol IUPAC Name: 2-[6-(1,3-benzodioxol-5-yl)-2-(5-bromo-2-methoxyphenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]phenol Traditional Name: 2-[6-(1,3-benzodioxol-5-yl)-2-(5-bromo-2-methoxy-phenyl)-1,2,3,4-tetrahydropyrimidin-4-yl]phenol Formula: C24H21BrN2O4 MolecularWeight: 481.33854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2NC(C=C(N2)C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5O

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C2NC(C=C(N2)C3=CC4=C(C=C3)OCO4)C5=CC=CC=C5O

InChI

InChI=1S/C24H21BrN2O4/c1-29-21-9-7-15(25)11-17(21)24-26-18(14-6-8-22-23(10-14)31-13-30-22)12-19(27-24)16-4-2-3-5-20(16)28/h2-12,19,24,26-28H,13H2,1H3