2-[2-(4-bromanylphenoxy)ethylsulfanyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine

Systemtic Name: 2-[2-(4-bromanylphenoxy)ethylsulfanyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine Openeye Name: 2-[2-(4-bromophenoxy)ethylsulfanyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine CAS Name: 2-[2-(4-bromophenoxy)ethylthio]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine IUPAC Name: 2-[2-(4-bromophenoxy)ethylsulfanyl]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine Traditional Name: 2-[2-(4-bromophenoxy)ethylthio]-5,5-dimethyl-4,6-dihydro-1H-pyrimidine Formula: C14H19BrN2OS MolecularWeight: 343.28246

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CNC(=NC1)SCCOC2=CC=C(C=C2)Br)C

Isomeric SMILES

CC1(CNC(=NC1)SCCOC2=CC=C(C=C2)Br)C

InChI

InChI=1S/C14H19BrN2OS/c1-14(2)9-16-13(17-10-14)19-8-7-18-12-5-3-11(15)4-6-12/h3-6H,7-10H2,1-2H3,(H,16,17)