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

Systemtic Name: 3-[2-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxidanylidene-ethyl]-5,6-dimethyl-pyrimidin-4-one Openeye Name: 3-[2-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxo-ethyl]-5,6-dimethyl-pyrimidin-4-one CAS Name: 3-[2-[4-(4-ethoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]-2-oxoethyl]-5,6-dimethyl-4-pyrimidinone IUPAC Name: 3-[2-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-oxoethyl]-5,6-dimethylpyrimidin-4-one Traditional Name: 3-[2-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazino]-2-keto-ethyl]-5,6-dimethyl-pyrimidin-4-one Formula: C21H25N5O3S MolecularWeight: 427.5199

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)CN4C=NC(=C(C4=O)C)C

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)CN4C=NC(=C(C4=O)C)C

InChI

InChI=1S/C21H25N5O3S/c1-4-29-16-6-5-7-17-19(16)23-21(30-17)25-10-8-24(9-11-25)18(27)12-26-13-22-15(3)14(2)20(26)28/h5-7,13H,4,8-12H2,1-3H3