N-[3-(diethylaminomethyl)-4-methoxy-phenyl]-5H-purin-6-amine

Systemtic Name: N-[3-(diethylaminomethyl)-4-methoxy-phenyl]-5H-purin-6-amine Openeye Name: N-[3-(diethylaminomethyl)-4-methoxy-phenyl]-5H-purin-6-amine CAS Name: N-[3-(diethylaminomethyl)-4-methoxyphenyl]-5H-purin-6-amine IUPAC Name: N-[3-(diethylaminomethyl)-4-methoxyphenyl]-5H-purin-6-amine Traditional Name: diethyl-[2-methoxy-5-(5H-purin-6-ylamino)benzyl]amine Formula: C17H22N6O MolecularWeight: 326.39618

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C=CC(=C1)NC2=NC=NC3=NC=NC32)OC

Isomeric SMILES

CCN(CC)CC1=C(C=CC(=C1)NC2=NC=NC3=NC=NC32)OC

InChI

InChI=1S/C17H22N6O/c1-4-23(5-2)9-12-8-13(6-7-14(12)24-3)22-17-15-16(19-10-18-15)20-11-21-17/h6-8,10-11,15H,4-5,9H2,1-3H3,(H,18,19,20,21,22)