2-[3-[(4-methyl-3-oxidanylidene-piperazin-1-yl)methyl]phenyl]-6-(2-methyl-1,3-thiazol-4-yl)-1H-pyrimidin-4-one

Systemtic Name: 2-[3-[(4-methyl-3-oxidanylidene-piperazin-1-yl)methyl]phenyl]-6-(2-methyl-1,3-thiazol-4-yl)-1H-pyrimidin-4-one Openeye Name: 2-[3-[(4-methyl-3-oxo-piperazin-1-yl)methyl]phenyl]-6-(2-methylthiazol-4-yl)-1H-pyrimidin-4-one CAS Name: 2-[3-[(4-methyl-3-oxo-1-piperazinyl)methyl]phenyl]-6-(2-methyl-4-thiazolyl)-1H-pyrimidin-4-one IUPAC Name: 2-[3-[(4-methyl-3-oxopiperazin-1-yl)methyl]phenyl]-6-(2-methyl-1,3-thiazol-4-yl)-1H-pyrimidin-4-one Traditional Name: 2-[3-[(3-keto-4-methyl-piperazino)methyl]phenyl]-6-(2-methylthiazol-4-yl)-1H-pyrimidin-4-one Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C2=CC(=O)N=C(N2)C3=CC(=CC=C3)CN4CCN(C(=O)C4)C

Isomeric SMILES

CC1=NC(=CS1)C2=CC(=O)N=C(N2)C3=CC(=CC=C3)CN4CCN(C(=O)C4)C

InChI

InChI=1S/C20H21N5O2S/c1-13-21-17(12-28-13)16-9-18(26)23-20(22-16)15-5-3-4-14(8-15)10-25-7-6-24(2)19(27)11-25/h3-5,8-9,12H,6-7,10-11H2,1-2H3,(H,22,23,26)