2-[2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-3-methoxy-phenyl]-1,4,5,6-tetrahydropyrimidin-5-ol

Systemtic Name: 2-[2-[(5-bromanyl-2-methoxy-phenyl)methylsulfanyl]-3-methoxy-phenyl]-1,4,5,6-tetrahydropyrimidin-5-ol Openeye Name: 2-[2-[(5-bromo-2-methoxy-phenyl)methylsulfanyl]-3-methoxy-phenyl]-1,4,5,6-tetrahydropyrimidin-5-ol CAS Name: 2-[2-[(5-bromo-2-methoxyphenyl)methylthio]-3-methoxyphenyl]-1,4,5,6-tetrahydropyrimidin-5-ol IUPAC Name: 2-[2-[(5-bromo-2-methoxyphenyl)methylsulfanyl]-3-methoxyphenyl]-1,4,5,6-tetrahydropyrimidin-5-ol Traditional Name: 2-[2-[(5-bromo-2-methoxy-benzyl)thio]-3-methoxy-phenyl]-1,4,5,6-tetrahydropyrimidin-5-ol Formula: C19H21BrN2O3S MolecularWeight: 437.35064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CSC2=C(C=CC=C2OC)C3=NCC(CN3)O

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CSC2=C(C=CC=C2OC)C3=NCC(CN3)O

InChI

InChI=1S/C19H21BrN2O3S/c1-24-16-7-6-13(20)8-12(16)11-26-18-15(4-3-5-17(18)25-2)19-21-9-14(23)10-22-19/h3-8,14,23H,9-11H2,1-2H3,(H,21,22)