2-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethylamino]-5-[(6-oxidanylidene-1H-pyridin-3-yl)methyl]-1H-pyrimidin-6-one trihydrochloride

Systemtic Name: 2-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethylamino]-5-[(6-oxidanylidene-1H-pyridin-3-yl)methyl]-1H-pyrimidin-6-one trihydrochloride Openeye Name: 2-[2-[[5-(dimethylaminomethyl)-2-furyl]methylsulfanyl]ethylamino]-5-[(6-oxo-1H-pyridin-3-yl)methyl]-1H-pyrimidin-6-one trihydrochloride CAS Name: 2-[2-[[5-(dimethylaminomethyl)-2-furanyl]methylthio]ethylamino]-5-[(6-oxo-1H-pyridin-3-yl)methyl]-1H-pyrimidin-6-one trihydrochloride IUPAC Name: 2-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethylamino]-5-[(6-oxo-1H-pyridin-3-yl)methyl]-1H-pyrimidin-6-one trihydrochloride Traditional Name: 2-[2-[[5-(dimethylaminomethyl)-2-furyl]methylthio]ethylamino]-5-[(6-keto-1H-pyridin-3-yl)methyl]-1H-pyrimidin-6-one trihydrochloride Formula: C20H28Cl3N5O3S MolecularWeight: 524.89202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=C(O1)CSCCNC2=NC=C(C(=O)N2)CC3=CNC(=O)C=C3.Cl.Cl.Cl

Isomeric SMILES

CN(C)CC1=CC=C(O1)CSCCNC2=NC=C(C(=O)N2)CC3=CNC(=O)C=C3.Cl.Cl.Cl

InChI

InChI=1S/C20H25N5O3S.3ClH/c1-25(2)12-16-4-5-17(28-16)13-29-8-7-21-20-23-11-15(19(27)24-20)9-14-3-6-18(26)22-10-14;;;/h3-6,10-11H,7-9,12-13H2,1-2H3,(H,22,26)(H2,21,23,24,27);3*1H