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

Systemtic Name: 6-[(3S)-1-[2-(1-methylindol-3-yl)ethanoyl]piperidin-3-yl]-1H-pyrimidin-4-one Openeye Name: 6-[(3S)-1-[2-(1-methylindol-3-yl)acetyl]-3-piperidyl]-1H-pyrimidin-4-one CAS Name: 6-[(3S)-1-[2-(1-methyl-3-indolyl)-1-oxoethyl]-3-piperidinyl]-1H-pyrimidin-4-one IUPAC Name: 6-[(3S)-1-[2-(1-methylindol-3-yl)acetyl]piperidin-3-yl]-1H-pyrimidin-4-one Traditional Name: 6-[(3S)-1-[2-(1-methylindol-3-yl)acetyl]-3-piperidyl]-1H-pyrimidin-4-one Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)CC(=O)N3CCCC(C3)C4=CC(=O)N=CN4

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)CC(=O)N3CCC[C@@H](C3)C4=CC(=O)N=CN4

InChI

InChI=1S/C20H22N4O2/c1-23-11-15(16-6-2-3-7-18(16)23)9-20(26)24-8-4-5-14(12-24)17-10-19(25)22-13-21-17/h2-3,6-7,10-11,13-14H,4-5,8-9,12H2,1H3,(H,21,22,25)/t14-/m0/s1