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

Systemtic Name: 2-[3-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]propylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Openeye Name: 2-[3-[[5-(dimethylaminomethyl)-2-furyl]methylsulfanyl]propylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one CAS Name: 2-[3-[[5-(dimethylaminomethyl)-2-furanyl]methylthio]propylamino]-5-(3-pyridinylmethyl)-1H-pyrimidin-6-one IUPAC Name: 2-[3-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]propylamino]-5-(pyridin-3-ylmethyl)-1H-pyrimidin-6-one Traditional Name: 2-[3-[[5-(dimethylaminomethyl)-2-furyl]methylthio]propylamino]-5-(3-pyridylmethyl)-1H-pyrimidin-6-one Formula: C21H27N5O2S MolecularWeight: 413.53638

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(O1)CSCCCNC2=NC=C(C(=O)N2)CC3=CN=CC=C3

Isomeric SMILES

CN(C)CC1=CC=C(O1)CSCCCNC2=NC=C(C(=O)N2)CC3=CN=CC=C3

InChI

InChI=1S/C21H27N5O2S/c1-26(2)14-18-6-7-19(28-18)15-29-10-4-9-23-21-24-13-17(20(27)25-21)11-16-5-3-8-22-12-16/h3,5-8,12-13H,4,9-11,14-15H2,1-2H3,(H2,23,24,25,27)