9-ethyl-8-(4-methylpyrazol-1-yl)-N2-[(1R)-1-phenylethyl]purine-2,6-diamine

Systemtic Name: 9-ethyl-8-(4-methylpyrazol-1-yl)-N2-[(1R)-1-phenylethyl]purine-2,6-diamine Openeye Name: 9-ethyl-8-(4-methylpyrazol-1-yl)-N2-[(1R)-1-phenylethyl]purine-2,6-diamine CAS Name: 9-ethyl-8-(4-methyl-1-pyrazolyl)-N2-[(1R)-1-phenylethyl]purine-2,6-diamine IUPAC Name: 9-ethyl-8-(4-methylpyrazol-1-yl)-2-N-[(1R)-1-phenylethyl]purine-2,6-diamine Traditional Name: [6-amino-9-ethyl-8-(4-methylpyrazol-1-yl)purin-2-yl]-[(1R)-1-phenylethyl]amine Formula: C19H22N8 MolecularWeight: 362.43158

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=NC(=N2)NC(C)C3=CC=CC=C3)N)N=C1N4C=C(C=N4)C

Isomeric SMILES

CCN1C2=C(C(=NC(=N2)N[C@H](C)C3=CC=CC=C3)N)N=C1N4C=C(C=N4)C

InChI

InChI=1S/C19H22N8/c1-4-26-17-15(23-19(26)27-11-12(2)10-21-27)16(20)24-18(25-17)22-13(3)14-8-6-5-7-9-14/h5-11,13H,4H2,1-3H3,(H3,20,22,24,25)/t13-/m1/s1