3-[2-[4-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-5,6-dimethyl-pyrimidin-4-one

Systemtic Name: 3-[2-[4-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-5,6-dimethyl-pyrimidin-4-one Openeye Name: 3-[2-[4-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxo-ethyl]-5,6-dimethyl-pyrimidin-4-one CAS Name: 3-[2-[4-(4,6-dimethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-2-oxoethyl]-5,6-dimethyl-4-pyrimidinone IUPAC Name: 3-[2-[4-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxoethyl]-5,6-dimethylpyrimidin-4-one Traditional Name: 3-[2-[4-(4,6-dimethyl-1,3-benzothiazol-2-yl)piperazino]-2-keto-ethyl]-5,6-dimethyl-pyrimidin-4-one Formula: C21H25N5O2S MolecularWeight: 411.5205

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3CCN(CC3)C(=O)CN4C=NC(=C(C4=O)C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3CCN(CC3)C(=O)CN4C=NC(=C(C4=O)C)C)C

InChI

InChI=1S/C21H25N5O2S/c1-13-9-14(2)19-17(10-13)29-21(23-19)25-7-5-24(6-8-25)18(27)11-26-12-22-16(4)15(3)20(26)28/h9-10,12H,5-8,11H2,1-4H3