5-(cyclohexylmethyl)-2-[2-[[3-(dimethylaminomethyl)phenyl]methylsulfanyl]ethylamino]-1H-pyrimidin-6-one

Systemtic Name: 5-(cyclohexylmethyl)-2-[2-[[3-(dimethylaminomethyl)phenyl]methylsulfanyl]ethylamino]-1H-pyrimidin-6-one Openeye Name: 5-(cyclohexylmethyl)-2-[2-[[3-(dimethylaminomethyl)phenyl]methylsulfanyl]ethylamino]-1H-pyrimidin-6-one CAS Name: 5-(cyclohexylmethyl)-2-[2-[[3-(dimethylaminomethyl)phenyl]methylthio]ethylamino]-1H-pyrimidin-6-one IUPAC Name: 5-(cyclohexylmethyl)-2-[2-[[3-(dimethylaminomethyl)phenyl]methylsulfanyl]ethylamino]-1H-pyrimidin-6-one Traditional Name: 5-(cyclohexylmethyl)-2-[2-[[3-(dimethylaminomethyl)benzyl]thio]ethylamino]-1H-pyrimidin-6-one Formula: C23H34N4OS MolecularWeight: 414.60726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(=CC=C1)CSCCNC2=NC=C(C(=O)N2)CC3CCCCC3

Isomeric SMILES

CN(C)CC1=CC(=CC=C1)CSCCNC2=NC=C(C(=O)N2)CC3CCCCC3

InChI

InChI=1S/C23H34N4OS/c1-27(2)16-19-9-6-10-20(13-19)17-29-12-11-24-23-25-15-21(22(28)26-23)14-18-7-4-3-5-8-18/h6,9-10,13,15,18H,3-5,7-8,11-12,14,16-17H2,1-2H3,(H2,24,25,26,28)