5-(pyridin-3-ylmethyl)-2-[2-[[5-(pyrrolidin-1-ylmethyl)furan-2-yl]methylsulfanyl]ethylamino]-1H-pyrimidin-6-one

Systemtic Name: 5-(pyridin-3-ylmethyl)-2-[2-[[5-(pyrrolidin-1-ylmethyl)furan-2-yl]methylsulfanyl]ethylamino]-1H-pyrimidin-6-one Openeye Name: 5-(3-pyridylmethyl)-2-[2-[[5-(pyrrolidin-1-ylmethyl)-2-furyl]methylsulfanyl]ethylamino]-1H-pyrimidin-6-one CAS Name: 5-(3-pyridinylmethyl)-2-[2-[[5-(1-pyrrolidinylmethyl)-2-furanyl]methylthio]ethylamino]-1H-pyrimidin-6-one IUPAC Name: 5-(pyridin-3-ylmethyl)-2-[2-[[5-(pyrrolidin-1-ylmethyl)furan-2-yl]methylsulfanyl]ethylamino]-1H-pyrimidin-6-one Traditional Name: 5-(3-pyridylmethyl)-2-[2-[[5-(pyrrolidinomethyl)-2-furyl]methylthio]ethylamino]-1H-pyrimidin-6-one Formula: C22H27N5O2S MolecularWeight: 425.54708

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(O2)CSCCNC3=NC=C(C(=O)N3)CC4=CN=CC=C4

Isomeric SMILES

C1CCN(C1)CC2=CC=C(O2)CSCCNC3=NC=C(C(=O)N3)CC4=CN=CC=C4

InChI

InChI=1S/C22H27N5O2S/c28-21-18(12-17-4-3-7-23-13-17)14-25-22(26-21)24-8-11-30-16-20-6-5-19(29-20)15-27-9-1-2-10-27/h3-7,13-14H,1-2,8-12,15-16H2,(H2,24,25,26,28)