9-[3-(aminomethyl)phenyl]-N-ethyl-6-propan-2-yl-purin-2-amine

Systemtic Name: 9-[3-(aminomethyl)phenyl]-N-ethyl-6-propan-2-yl-purin-2-amine Openeye Name: 9-[3-(aminomethyl)phenyl]-N-ethyl-6-isopropyl-purin-2-amine CAS Name: 9-[3-(aminomethyl)phenyl]-N-ethyl-6-propan-2-yl-2-purinamine IUPAC Name: 9-[3-(aminomethyl)phenyl]-N-ethyl-6-propan-2-ylpurin-2-amine Traditional Name: [9-[3-(aminomethyl)phenyl]-6-isopropyl-purin-2-yl]-ethyl-amine Formula: C17H22N6 MolecularWeight: 310.39678

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=C2C(=N1)N(C=N2)C3=CC=CC(=C3)CN)C(C)C

Isomeric SMILES

CCNC1=NC(=C2C(=N1)N(C=N2)C3=CC=CC(=C3)CN)C(C)C

InChI

InChI=1S/C17H22N6/c1-4-19-17-21-14(11(2)3)15-16(22-17)23(10-20-15)13-7-5-6-12(8-13)9-18/h5-8,10-11H,4,9,18H2,1-3H3,(H,19,21,22)