2-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethylamino]-5-(phenylmethyl)-1H-pyrimidin-6-one

Systemtic Name: 2-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethylamino]-5-(phenylmethyl)-1H-pyrimidin-6-one Openeye Name: 5-benzyl-2-[2-[[5-(dimethylaminomethyl)-2-furyl]methylsulfanyl]ethylamino]-1H-pyrimidin-6-one CAS Name: 2-[2-[[5-(dimethylaminomethyl)-2-furanyl]methylthio]ethylamino]-5-(phenylmethyl)-1H-pyrimidin-6-one IUPAC Name: 5-benzyl-2-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethylamino]-1H-pyrimidin-6-one Traditional Name: 5-benzyl-2-[2-[[5-(dimethylaminomethyl)-2-furyl]methylthio]ethylamino]-1H-pyrimidin-6-one Formula: C21H26N4O2S MolecularWeight: 398.52174

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=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H26N4O2S/c1-25(2)14-18-8-9-19(27-18)15-28-11-10-22-21-23-13-17(20(26)24-21)12-16-6-4-3-5-7-16/h3-9,13H,10-12,14-15H2,1-2H3,(H2,22,23,24,26)