3-azanyl-5-[5-(1,2-oxazol-4-yl)-2-oxidanyl-phenyl]-1-piperidin-3-yl-pyrazin-2-one

Systemtic Name: 3-azanyl-5-[5-(1,2-oxazol-4-yl)-2-oxidanyl-phenyl]-1-piperidin-3-yl-pyrazin-2-one Openeye Name: 3-amino-5-(2-hydroxy-5-isoxazol-4-yl-phenyl)-1-(3-piperidyl)pyrazin-2-one CAS Name: 3-amino-5-[2-hydroxy-5-(4-isoxazolyl)phenyl]-1-(3-piperidinyl)-2-pyrazinone IUPAC Name: 3-amino-5-[2-hydroxy-5-(1,2-oxazol-4-yl)phenyl]-1-piperidin-3-ylpyrazin-2-one Traditional Name: 3-amino-5-(2-hydroxy-5-isoxazol-4-yl-phenyl)-1-(3-piperidyl)pyrazin-2-one Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)N2C=C(N=C(C2=O)N)C3=C(C=CC(=C3)C4=CON=C4)O

Isomeric SMILES

C1CC(CNC1)N2C=C(N=C(C2=O)N)C3=C(C=CC(=C3)C4=CON=C4)O

InChI

InChI=1S/C18H19N5O3/c19-17-18(25)23(13-2-1-5-20-8-13)9-15(22-17)14-6-11(3-4-16(14)24)12-7-21-26-10-12/h3-4,6-7,9-10,13,20,24H,1-2,5,8H2,(H2,19,22)