2-[[8-chloranyl-6-[(3-chlorophenyl)amino]-9-propan-2-yl-purin-2-yl]amino]-3-methyl-butan-1-ol

Systemtic Name: 2-[[8-chloranyl-6-[(3-chlorophenyl)amino]-9-propan-2-yl-purin-2-yl]amino]-3-methyl-butan-1-ol Openeye Name: 2-[[8-chloro-6-(3-chloroanilino)-9-isopropyl-purin-2-yl]amino]-3-methyl-butan-1-ol CAS Name: 2-[[8-chloro-6-(3-chloroanilino)-9-propan-2-yl-2-purinyl]amino]-3-methyl-1-butanol IUPAC Name: 2-[[8-chloro-6-(3-chloroanilino)-9-propan-2-ylpurin-2-yl]amino]-3-methylbutan-1-ol Traditional Name: 2-[[8-chloro-6-(3-chloroanilino)-9-isopropyl-purin-2-yl]amino]-3-methyl-butan-1-ol Formula: C19H24Cl2N6O MolecularWeight: 423.33946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CO)NC1=NC2=C(C(=N1)NC3=CC(=CC=C3)Cl)N=C(N2C(C)C)Cl

Isomeric SMILES

CC(C)C(CO)NC1=NC2=C(C(=N1)NC3=CC(=CC=C3)Cl)N=C(N2C(C)C)Cl

InChI

InChI=1S/C19H24Cl2N6O/c1-10(2)14(9-28)23-19-25-16(22-13-7-5-6-12(20)8-13)15-17(26-19)27(11(3)4)18(21)24-15/h5-8,10-11,14,28H,9H2,1-4H3,(H2,22,23,25,26)