8-(4-ethenylpyrazol-1-yl)-9-ethyl-N2-(phenylmethyl)-4,5-dihydropurine-2,6-diamine

Systemtic Name: 8-(4-ethenylpyrazol-1-yl)-9-ethyl-N2-(phenylmethyl)-4,5-dihydropurine-2,6-diamine Openeye Name: N2-benzyl-9-ethyl-8-(4-vinylpyrazol-1-yl)-4,5-dihydropurine-2,6-diamine CAS Name: 8-(4-ethenyl-1-pyrazolyl)-9-ethyl-N2-(phenylmethyl)-4,5-dihydropurine-2,6-diamine IUPAC Name: 2-N-benzyl-8-(4-ethenylpyrazol-1-yl)-9-ethyl-4,5-dihydropurine-2,6-diamine Traditional Name: [6-amino-9-ethyl-8-(4-vinylpyrazol-1-yl)-4,5-dihydropurin-2-yl]-benzyl-amine Formula: C19H22N8 MolecularWeight: 362.43158

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2C(C(=NC(=N2)NCC3=CC=CC=C3)N)N=C1N4C=C(C=N4)C=C

Isomeric SMILES

CCN1C2C(C(=NC(=N2)NCC3=CC=CC=C3)N)N=C1N4C=C(C=N4)C=C

InChI

InChI=1S/C19H22N8/c1-3-13-11-22-27(12-13)19-23-15-16(20)24-18(25-17(15)26(19)4-2)21-10-14-8-6-5-7-9-14/h3,5-9,11-12,15,17H,1,4,10H2,2H3,(H3,20,21,24,25)