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

Systemtic Name: 3-azanyl-5-(5-cyclohexyloxy-2-oxidanyl-phenyl)-1-piperidin-3-yl-pyrazin-2-one Openeye Name: 3-amino-5-[5-(cyclohexoxy)-2-hydroxy-phenyl]-1-(3-piperidyl)pyrazin-2-one CAS Name: 3-amino-5-(5-cyclohexyloxy-2-hydroxyphenyl)-1-(3-piperidinyl)-2-pyrazinone IUPAC Name: 3-amino-5-(5-cyclohexyloxy-2-hydroxyphenyl)-1-piperidin-3-ylpyrazin-2-one Traditional Name: 3-amino-5-[5-(cyclohexoxy)-2-hydroxy-phenyl]-1-(3-piperidyl)pyrazin-2-one Formula: C21H28N4O3 MolecularWeight: 384.47202

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC2=CC(=C(C=C2)O)C3=CN(C(=O)C(=N3)N)C4CCCNC4

Isomeric SMILES

C1CCC(CC1)OC2=CC(=C(C=C2)O)C3=CN(C(=O)C(=N3)N)C4CCCNC4

InChI

InChI=1S/C21H28N4O3/c22-20-21(27)25(14-5-4-10-23-12-14)13-18(24-20)17-11-16(8-9-19(17)26)28-15-6-2-1-3-7-15/h8-9,11,13-15,23,26H,1-7,10,12H2,(H2,22,24)