N-ethyl-N-[4-[[6-(propan-2-ylamino)-7H-purin-2-yl]amino]phenyl]ethanamide

Systemtic Name: N-ethyl-N-[4-[[6-(propan-2-ylamino)-7H-purin-2-yl]amino]phenyl]ethanamide Openeye Name: N-ethyl-N-[4-[[6-(isopropylamino)-7H-purin-2-yl]amino]phenyl]acetamide CAS Name: N-ethyl-N-[4-[[6-(propan-2-ylamino)-7H-purin-2-yl]amino]phenyl]acetamide IUPAC Name: N-ethyl-N-[4-[[6-(propan-2-ylamino)-7H-purin-2-yl]amino]phenyl]acetamide Traditional Name: N-ethyl-N-[4-[[6-(isopropylamino)-7H-purin-2-yl]amino]phenyl]acetamide Formula: C18H23N7O MolecularWeight: 353.42152

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)NC2=NC3=C(C(=N2)NC(C)C)NC=N3)C(=O)C

Isomeric SMILES

CCN(C1=CC=C(C=C1)NC2=NC3=C(C(=N2)NC(C)C)NC=N3)C(=O)C

InChI

InChI=1S/C18H23N7O/c1-5-25(12(4)26)14-8-6-13(7-9-14)22-18-23-16-15(19-10-20-16)17(24-18)21-11(2)3/h6-11H,5H2,1-4H3,(H3,19,20,21,22,23,24)