3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-2-(3,5-dimethylpyrazol-1-yl)-5-ethyl-6-methyl-pyrimidin-4-one

Systemtic Name: 3-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-2-(3,5-dimethylpyrazol-1-yl)-5-ethyl-6-methyl-pyrimidin-4-one Openeye Name: 3-[2-(azepan-1-yl)-2-oxo-ethyl]-2-(3,5-dimethylpyrazol-1-yl)-5-ethyl-6-methyl-pyrimidin-4-one CAS Name: 3-[2-(1-azepanyl)-2-oxoethyl]-2-(3,5-dimethyl-1-pyrazolyl)-5-ethyl-6-methyl-4-pyrimidinone IUPAC Name: 3-[2-(azepan-1-yl)-2-oxoethyl]-2-(3,5-dimethylpyrazol-1-yl)-5-ethyl-6-methylpyrimidin-4-one Traditional Name: 3-[2-(azepan-1-yl)-2-keto-ethyl]-2-(3,5-dimethylpyrazol-1-yl)-5-ethyl-6-methyl-pyrimidin-4-one Formula: C20H29N5O2 MolecularWeight: 371.47656

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(N(C1=O)CC(=O)N2CCCCCC2)N3C(=CC(=N3)C)C)C

Isomeric SMILES

CCC1=C(N=C(N(C1=O)CC(=O)N2CCCCCC2)N3C(=CC(=N3)C)C)C

InChI

InChI=1S/C20H29N5O2/c1-5-17-16(4)21-20(25-15(3)12-14(2)22-25)24(19(17)27)13-18(26)23-10-8-6-7-9-11-23/h12H,5-11,13H2,1-4H3