6-[(3S)-1-[(1S)-2,2-dimethyl-1-thiophen-2-yl-cyclopropyl]carbonylpiperidin-3-yl]-1H-pyrimidin-4-one

Systemtic Name: 6-[(3S)-1-[(1S)-2,2-dimethyl-1-thiophen-2-yl-cyclopropyl]carbonylpiperidin-3-yl]-1H-pyrimidin-4-one Openeye Name: 6-[(3S)-1-[(1S)-2,2-dimethyl-1-(2-thienyl)cyclopropanecarbonyl]-3-piperidyl]-1H-pyrimidin-4-one CAS Name: 6-[(3S)-1-[[(1S)-2,2-dimethyl-1-thiophen-2-ylcyclopropyl]-oxomethyl]-3-piperidinyl]-1H-pyrimidin-4-one IUPAC Name: 6-[(3S)-1-[(1S)-2,2-dimethyl-1-thiophen-2-ylcyclopropanecarbonyl]piperidin-3-yl]-1H-pyrimidin-4-one Traditional Name: 6-[(3S)-1-[(1S)-2,2-dimethyl-1-(2-thienyl)cyclopropanecarbonyl]-3-piperidyl]-1H-pyrimidin-4-one Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1(C2=CC=CS2)C(=O)N3CCCC(C3)C4=CC(=O)N=CN4)C

Isomeric SMILES

CC1(C[C@@]1(C2=CC=CS2)C(=O)N3CCC[C@@H](C3)C4=CC(=O)N=CN4)C

InChI

InChI=1S/C19H23N3O2S/c1-18(2)11-19(18,15-6-4-8-25-15)17(24)22-7-3-5-13(10-22)14-9-16(23)21-12-20-14/h4,6,8-9,12-13H,3,5,7,10-11H2,1-2H3,(H,20,21,23)/t13-,19+/m0/s1