4-[2-(3-bromanylphenoxy)ethylsulfanyl]-5,6-dimethyl-thieno[2,3-d]pyrimidine

Systemtic Name: 4-[2-(3-bromanylphenoxy)ethylsulfanyl]-5,6-dimethyl-thieno[2,3-d]pyrimidine Openeye Name: 4-[2-(3-bromophenoxy)ethylsulfanyl]-5,6-dimethyl-thieno[2,3-d]pyrimidine CAS Name: 4-[2-(3-bromophenoxy)ethylthio]-5,6-dimethylthieno[2,3-d]pyrimidine IUPAC Name: 4-[2-(3-bromophenoxy)ethylsulfanyl]-5,6-dimethylthieno[2,3-d]pyrimidine Traditional Name: 4-[2-(3-bromophenoxy)ethylthio]-5,6-dimethyl-thieno[2,3-d]pyrimidine Formula: C16H15BrN2OS2 MolecularWeight: 395.3371

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SCCOC3=CC(=CC=C3)Br)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SCCOC3=CC(=CC=C3)Br)C

InChI

InChI=1S/C16H15BrN2OS2/c1-10-11(2)22-16-14(10)15(18-9-19-16)21-7-6-20-13-5-3-4-12(17)8-13/h3-5,8-9H,6-7H2,1-2H3