2-[2-[(5-bromanyl-2-methoxy-cyclohexa-2,4-dien-1-yl)methylsulfanyl]phenyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine

Systemtic Name: 2-[2-[(5-bromanyl-2-methoxy-cyclohexa-2,4-dien-1-yl)methylsulfanyl]phenyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine Openeye Name: 2-[2-[(5-bromo-2-methoxy-cyclohexa-2,4-dien-1-yl)methylsulfanyl]phenyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine CAS Name: 2-[2-[(5-bromo-2-methoxy-1-cyclohexa-2,4-dienyl)methylthio]phenyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine IUPAC Name: 2-[2-[(5-bromo-2-methoxycyclohexa-2,4-dien-1-yl)methylsulfanyl]phenyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine Traditional Name: 2-[2-[(5-bromo-2-methoxy-cyclohexa-2,4-dien-1-yl)methylthio]phenyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine Formula: C20H25BrN2OS MolecularWeight: 421.3943

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CNC(=NC1)C2=CC=CC=C2SCC3CC(=CC=C3OC)Br)C

Isomeric SMILES

CC1(CNC(=NC1)C2=CC=CC=C2SCC3CC(=CC=C3OC)Br)C

InChI

InChI=1S/C20H25BrN2OS/c1-20(2)12-22-19(23-13-20)16-6-4-5-7-18(16)25-11-14-10-15(21)8-9-17(14)24-3/h4-9,14H,10-13H2,1-3H3,(H,22,23)