3-[2-[(3S)-3-(4-oxidanylidene-1H-pyrimidin-6-yl)piperidin-1-yl]ethyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[2-[(3S)-3-(4-oxidanylidene-1H-pyrimidin-6-yl)piperidin-1-yl]ethyl]-1,3-benzoxazol-2-one Openeye Name: 3-[2-[(3S)-3-(4-oxo-1H-pyrimidin-6-yl)-1-piperidyl]ethyl]-1,3-benzoxazol-2-one CAS Name: 3-[2-[(3S)-3-(4-oxo-1H-pyrimidin-6-yl)-1-piperidinyl]ethyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[2-[(3S)-3-(4-oxo-1H-pyrimidin-6-yl)piperidin-1-yl]ethyl]-1,3-benzoxazol-2-one Traditional Name: 3-[2-[(3S)-3-(4-keto-1H-pyrimidin-6-yl)piperidino]ethyl]-1,3-benzoxazol-2-one Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCN2C3=CC=CC=C3OC2=O)C4=CC(=O)N=CN4

Isomeric SMILES

C1C[C@@H](CN(C1)CCN2C3=CC=CC=C3OC2=O)C4=CC(=O)N=CN4

InChI

InChI=1S/C18H20N4O3/c23-17-10-14(19-12-20-17)13-4-3-7-21(11-13)8-9-22-15-5-1-2-6-16(15)25-18(22)24/h1-2,5-6,10,12-13H,3-4,7-9,11H2,(H,19,20,23)/t13-/m0/s1