ethyl 4-[[2-[(4-azanylcyclohexyl)amino]-7H-purin-6-yl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[2-[(4-azanylcyclohexyl)amino]-7H-purin-6-yl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[(4-aminocyclohexyl)amino]-7H-purin-6-yl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-[(4-aminocyclohexyl)amino]-7H-purin-6-yl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(4-aminocyclohexyl)amino]-7H-purin-6-yl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-[(4-aminocyclohexyl)amino]-7H-purin-6-yl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C19H30N8O2 MolecularWeight: 402.4939

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC2=NC(=NC3=C2NC=N3)NC4CCC(CC4)N

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC2=NC(=NC3=C2NC=N3)NC4CCC(CC4)N

InChI

InChI=1S/C19H30N8O2/c1-2-29-19(28)27-9-7-14(8-10-27)23-17-15-16(22-11-21-15)25-18(26-17)24-13-5-3-12(20)4-6-13/h11-14H,2-10,20H2,1H3,(H3,21,22,23,24,25,26)