1-[(4-azanyl-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-(cyclohexylsulfanylmethyl)pyrrolidin-3-ol

Systemtic Name: 1-[(4-azanyl-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-(cyclohexylsulfanylmethyl)pyrrolidin-3-ol Openeye Name: 1-[(4-amino-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-(cyclohexylsulfanylmethyl)pyrrolidin-3-ol CAS Name: 1-[(4-amino-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-[(cyclohexylthio)methyl]-3-pyrrolidinol IUPAC Name: 1-[(4-amino-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-(cyclohexylsulfanylmethyl)pyrrolidin-3-ol Traditional Name: 1-[(4-amino-4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidin-7-yl)methyl]-4-[(cyclohexylthio)methyl]pyrrolidin-3-ol Formula: C18H29N5OS MolecularWeight: 363.52076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SCC2CN(CC2O)CC3=CNC4=C3NC=NC4N

Isomeric SMILES

C1CCC(CC1)SCC2CN(CC2O)CC3=CNC4=C3NC=NC4N

InChI

InChI=1S/C18H29N5OS/c19-18-17-16(21-11-22-18)12(6-20-17)7-23-8-13(15(24)9-23)10-25-14-4-2-1-3-5-14/h6,11,13-15,18,20,24H,1-5,7-10,19H2,(H,21,22)