4-[5-(propan-2-ylamino)pentylsulfanyl]pyrimidin-2-amine

Systemtic Name: 4-[5-(propan-2-ylamino)pentylsulfanyl]pyrimidin-2-amine Openeye Name: 4-[5-(isopropylamino)pentylsulfanyl]pyrimidin-2-amine CAS Name: 4-[5-(propan-2-ylamino)pentylthio]-2-pyrimidinamine IUPAC Name: 4-[5-(propan-2-ylamino)pentylsulfanyl]pyrimidin-2-amine Traditional Name: 5-[(2-aminopyrimidin-4-yl)thio]pentyl-isopropyl-amine Formula: C12H22N4S MolecularWeight: 254.39488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCCCCCSC1=NC(=NC=C1)N

Isomeric SMILES

CC(C)NCCCCCSC1=NC(=NC=C1)N

InChI

InChI=1S/C12H22N4S/c1-10(2)14-7-4-3-5-9-17-11-6-8-15-12(13)16-11/h6,8,10,14H,3-5,7,9H2,1-2H3,(H2,13,15,16)