3-azanyl-5-(5-cycloheptyl-2-oxidanyl-phenyl)-1-piperidin-3-yl-pyrazin-2-one

Systemtic Name: 3-azanyl-5-(5-cycloheptyl-2-oxidanyl-phenyl)-1-piperidin-3-yl-pyrazin-2-one Openeye Name: 3-amino-5-(5-cycloheptyl-2-hydroxy-phenyl)-1-(3-piperidyl)pyrazin-2-one CAS Name: 3-amino-5-(5-cycloheptyl-2-hydroxyphenyl)-1-(3-piperidinyl)-2-pyrazinone IUPAC Name: 3-amino-5-(5-cycloheptyl-2-hydroxyphenyl)-1-piperidin-3-ylpyrazin-2-one Traditional Name: 3-amino-5-(5-cycloheptyl-2-hydroxy-phenyl)-1-(3-piperidyl)pyrazin-2-one Formula: C22H30N4O2 MolecularWeight: 382.4992

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C2=CC(=C(C=C2)O)C3=CN(C(=O)C(=N3)N)C4CCCNC4

Isomeric SMILES

C1CCCC(CC1)C2=CC(=C(C=C2)O)C3=CN(C(=O)C(=N3)N)C4CCCNC4

InChI

InChI=1S/C22H30N4O2/c23-21-22(28)26(17-8-5-11-24-13-17)14-19(25-21)18-12-16(9-10-20(18)27)15-6-3-1-2-4-7-15/h9-10,12,14-15,17,24,27H,1-8,11,13H2,(H2,23,25)