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

Systemtic Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5,6-dimethyl-3-prop-2-enyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-allyl-2-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[2-(4-bromophenyl)sulfonylethylthio]-5,6-dimethyl-3-prop-2-enyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[2-(4-bromophenyl)sulfonylethylsulfanyl]-5,6-dimethyl-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one Traditional Name: 3-allyl-2-(2-brosylethylthio)-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C19H19BrN2O3S3 MolecularWeight: 499.46476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19BrN2O3S3/c1-4-9-22-18(23)16-12(2)13(3)27-17(16)21-19(22)26-10-11-28(24,25)15-7-5-14(20)6-8-15/h4-8H,1,9-11H2,2-3H3