5-(4-bromophenyl)-6-methyl-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-bromophenyl)-6-methyl-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-bromophenyl)-6-methyl-3-[2-oxo-2-(1-piperidyl)ethyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-bromophenyl)-6-methyl-3-[2-oxo-2-(1-piperidinyl)ethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-bromophenyl)-6-methyl-3-(2-oxo-2-piperidin-1-ylethyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-bromophenyl)-3-(2-keto-2-piperidino-ethyl)-6-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C20H20BrN3O2S MolecularWeight: 446.3607

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=CN(C2=O)CC(=O)N3CCCCC3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C2=C(S1)N=CN(C2=O)CC(=O)N3CCCCC3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C20H20BrN3O2S/c1-13-17(14-5-7-15(21)8-6-14)18-19(27-13)22-12-24(20(18)26)11-16(25)23-9-3-2-4-10-23/h5-8,12H,2-4,9-11H2,1H3