9-(cyclohexylmethyl)-2-[[(3R)-pyrrolidin-3-yl]methylamino]-7H-purin-8-one

Systemtic Name: 9-(cyclohexylmethyl)-2-[[(3R)-pyrrolidin-3-yl]methylamino]-7H-purin-8-one Openeye Name: 9-(cyclohexylmethyl)-2-[[(3R)-pyrrolidin-3-yl]methylamino]-7H-purin-8-one CAS Name: 9-(cyclohexylmethyl)-2-[[(3R)-3-pyrrolidinyl]methylamino]-7H-purin-8-one IUPAC Name: 9-(cyclohexylmethyl)-2-[[(3R)-pyrrolidin-3-yl]methylamino]-7H-purin-8-one Traditional Name: 9-(cyclohexylmethyl)-2-[[(3R)-pyrrolidin-3-yl]methylamino]-7H-purin-8-one Formula: C17H26N6O MolecularWeight: 330.42794

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2C3=NC(=NC=C3NC2=O)NCC4CCNC4

Isomeric SMILES

C1CCC(CC1)CN2C3=NC(=NC=C3NC2=O)NC[C@@H]4CCNC4

InChI

InChI=1S/C17H26N6O/c24-17-21-14-10-20-16(19-9-13-6-7-18-8-13)22-15(14)23(17)11-12-4-2-1-3-5-12/h10,12-13,18H,1-9,11H2,(H,21,24)(H,19,20,22)/t13-/m1/s1