6-[(3S)-1-[2-(6-methyl-1-benzofuran-3-yl)ethanoyl]piperidin-3-yl]-1H-pyrimidin-4-one

Systemtic Name: 6-[(3S)-1-[2-(6-methyl-1-benzofuran-3-yl)ethanoyl]piperidin-3-yl]-1H-pyrimidin-4-one Openeye Name: 6-[(3S)-1-[2-(6-methylbenzofuran-3-yl)acetyl]-3-piperidyl]-1H-pyrimidin-4-one CAS Name: 6-[(3S)-1-[2-(6-methyl-3-benzofuranyl)-1-oxoethyl]-3-piperidinyl]-1H-pyrimidin-4-one IUPAC Name: 6-[(3S)-1-[2-(6-methyl-1-benzofuran-3-yl)acetyl]piperidin-3-yl]-1H-pyrimidin-4-one Traditional Name: 6-[(3S)-1-[2-(6-methylbenzofuran-3-yl)acetyl]-3-piperidyl]-1H-pyrimidin-4-one Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CO2)CC(=O)N3CCCC(C3)C4=CC(=O)N=CN4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CO2)CC(=O)N3CCC[C@@H](C3)C4=CC(=O)N=CN4

InChI

InChI=1S/C20H21N3O3/c1-13-4-5-16-15(11-26-18(16)7-13)8-20(25)23-6-2-3-14(10-23)17-9-19(24)22-12-21-17/h4-5,7,9,11-12,14H,2-3,6,8,10H2,1H3,(H,21,22,24)/t14-/m0/s1