2-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: 2-[2-(4-bromophenyl)sulfonylethylthio]-5,6-dimethyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine Traditional Name: [2-(2-brosylethylthio)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-yl]amine Formula: C16H16BrN3O2S3 MolecularWeight: 458.41614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)N)SCCS(=O)(=O)C3=CC=C(C=C3)Br)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)N)SCCS(=O)(=O)C3=CC=C(C=C3)Br)C

InChI

InChI=1S/C16H16BrN3O2S3/c1-9-10(2)24-15-13(9)14(18)19-16(20-15)23-7-8-25(21,22)12-5-3-11(17)4-6-12/h3-6H,7-8H2,1-2H3,(H2,18,19,20)