2-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethylamino]-6-methyl-5-phenethyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethylamino]-6-methyl-5-phenethyl-1H-pyrimidin-4-one Openeye Name: 2-[2-[[5-(dimethylaminomethyl)-2-furyl]methylsulfanyl]ethylamino]-6-methyl-5-phenethyl-1H-pyrimidin-4-one CAS Name: 2-[2-[[5-(dimethylaminomethyl)-2-furanyl]methylthio]ethylamino]-6-methyl-5-phenethyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethylamino]-6-methyl-5-phenethyl-1H-pyrimidin-4-one Traditional Name: 2-[2-[[5-(dimethylaminomethyl)-2-furyl]methylthio]ethylamino]-6-methyl-5-phenethyl-1H-pyrimidin-4-one Formula: C23H30N4O2S MolecularWeight: 426.5749

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)NCCSCC2=CC=C(O2)CN(C)C)CCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)N=C(N1)NCCSCC2=CC=C(O2)CN(C)C)CCC3=CC=CC=C3

InChI

InChI=1S/C23H30N4O2S/c1-17-21(12-9-18-7-5-4-6-8-18)22(28)26-23(25-17)24-13-14-30-16-20-11-10-19(29-20)15-27(2)3/h4-8,10-11H,9,12-16H2,1-3H3,(H2,24,25,26,28)