3-[2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-2-oxoethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-2-oxoethyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(4-brosylpiperazino)-2-keto-ethyl]thieno[2,3-d]pyrimidin-4-one Formula: C18H17BrN4O4S2 MolecularWeight: 497.38598

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C=NC3=C(C2=O)C=CS3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1C(=O)CN2C=NC3=C(C2=O)C=CS3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C18H17BrN4O4S2/c19-13-1-3-14(4-2-13)29(26,27)23-8-6-21(7-9-23)16(24)11-22-12-20-17-15(18(22)25)5-10-28-17/h1-5,10,12H,6-9,11H2