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

Systemtic Name: 2-[2-[[5-(methylaminomethyl)furan-2-yl]methylsulfanyl]ethylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-[2-[[5-(methylaminomethyl)-2-furyl]methylsulfanyl]ethylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[2-[[5-(methylaminomethyl)-2-furanyl]methylthio]ethylamino]-5-(3-pyridinylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[2-[[5-(methylaminomethyl)furan-2-yl]methylsulfanyl]ethylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[2-[[5-(methylaminomethyl)-2-furyl]methylthio]ethylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one Formula: C19H23N5O2S MolecularWeight: 385.48322

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC=C(O1)CSCCNC2=NC=C(C(=O)N2)CC3=CN=CC=C3

Isomeric SMILES

CNCC1=CC=C(O1)CSCCNC2=NC=C(C(=O)N2)CC3=CN=CC=C3

InChI

InChI=1S/C19H23N5O2S/c1-20-12-16-4-5-17(26-16)13-27-8-7-22-19-23-11-15(18(25)24-19)9-14-3-2-6-21-10-14/h2-6,10-11,20H,7-9,12-13H2,1H3,(H2,22,23,24,25)