8CD

1-{[(2S)-5-oxopyrrolidin-2-yl]methoxy}-7-[(propan-2-yl)oxy]isoquinoline-6-carboxamide


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Chemical Component Summary

Name1-{[(2S)-5-oxopyrrolidin-2-yl]methoxy}-7-[(propan-2-yl)oxy]isoquinoline-6-carboxamide
Identifiers1-[[(2~{S})-5-oxidanylidenepyrrolidin-2-yl]methoxy]-7-propan-2-yloxy-isoquinoline-6-carboxamide
FormulaC18 H21 N3 O4
Molecular Weight343.377
TypeNON-POLYMER
Isomeric SMILESCC(C)Oc1cc2c(ccnc2OC[C@@H]3CCC(=O)N3)cc1C(=O)N
InChIInChI=1S/C18H21N3O4/c1-10(2)25-15-8-13-11(7-14(15)17(19)23)5-6-20-18(13)24-9-12-3-4-16(22)21-12/h5-8,10,12H,3-4,9H2,1-2H3,(H2,19,23)(H,21,22)/t12-/m0/s1
InChIKeyYLJNGHKLWZPDSX-LBPRGKRZSA-N

Chemical Details

Formal Charge0
Atom Count46
Chiral Atom Count1
Bond Count48
Aromatic Bond Count11

Related Resource References

Resource NameReference
Pharos CHEMBL4092338
PubChem 118414671
ChEMBL CHEMBL4092338