4-[2-(4-bromophenyl)sulfonylethylsulfanyl]-2,5,6-trimethyl-thieno[2,3-d]pyrimidine

Systemtic Name: 4-[2-(4-bromophenyl)sulfonylethylsulfanyl]-2,5,6-trimethyl-thieno[2,3-d]pyrimidine Openeye Name: 4-[2-(4-bromophenyl)sulfonylethylsulfanyl]-2,5,6-trimethyl-thieno[2,3-d]pyrimidine CAS Name: 4-[2-(4-bromophenyl)sulfonylethylthio]-2,5,6-trimethylthieno[2,3-d]pyrimidine IUPAC Name: 4-[2-(4-bromophenyl)sulfonylethylsulfanyl]-2,5,6-trimethylthieno[2,3-d]pyrimidine Traditional Name: 4-(2-brosylethylthio)-2,5,6-trimethyl-thieno[2,3-d]pyrimidine Formula: C17H17BrN2O2S3 MolecularWeight: 457.42808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17BrN2O2S3/c1-10-11(2)24-17-15(10)16(19-12(3)20-17)23-8-9-25(21,22)14-6-4-13(18)5-7-14/h4-7H,8-9H2,1-3H3