ZSD

6-[(8R)-2-({[(3,5-dimethyl-1,2-oxazol-4-yl)methyl](methyl)amino}methyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5(4H)-yl]pyrimidin-4-amine

Created: 2021-05-28
Last modified:  2021-09-01

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Chemical Details

Formal Charge0
Atom Count51
Chiral Atom Count0
Bond Count54
Aromatic Bond Count16
2D diagram of ZSD
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Chemical Component Summary

Name6-[(8R)-2-({[(3,5-dimethyl-1,2-oxazol-4-yl)methyl](methyl)amino}methyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-5(4H)-yl]pyrimidin-4-amine
Systematic Name (OpenEye OEToolkits)6-[2-[[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methyl-amino]methyl]-6,7-dihydro-4~{H}-pyrazolo[1,5-a]pyrazin-5-yl]pyrimidin-4-amine
FormulaC18 H24 N8 O
Molecular Weight368.436
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01CN(Cc1c(C)onc1C)Cc1cc2CN(CCn2n1)c1cc(N)ncn1
SMILESCACTVS3.385CN(Cc1cc2CN(CCn2n1)c3cc(N)ncn3)Cc4c(C)onc4C
SMILESOpenEye OEToolkits2.0.7Cc1c(c(on1)C)CN(C)Cc2cc3n(n2)CCN(C3)c4cc(ncn4)N
Canonical SMILESCACTVS3.385 CN(Cc1cc2CN(CCn2n1)c3cc(N)ncn3)Cc4c(C)onc4C
Canonical SMILESOpenEye OEToolkits2.0.7 Cc1c(c(on1)C)CN(C)Cc2cc3n(n2)CCN(C3)c4cc(ncn4)N
InChIInChI1.03 InChI=1S/C18H24N8O/c1-12-16(13(2)27-23-12)10-24(3)8-14-6-15-9-25(4-5-26(15)22-14)18-7-17(19)20-11-21-18/h6-7,11H,4-5,8-10H2,1-3H3,(H2,19,20,21)
InChIKeyInChI1.03 UIAMVAYKSCWAMB-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 56900655