2-[2-[[6-[(3-chlorophenyl)amino]-9-ethyl-purin-2-yl]amino]ethyl]guanidine

Systemtic Name: 2-[2-[[6-[(3-chlorophenyl)amino]-9-ethyl-purin-2-yl]amino]ethyl]guanidine Openeye Name: 2-[2-[[6-(3-chloroanilino)-9-ethyl-purin-2-yl]amino]ethyl]guanidine CAS Name: 2-[2-[[6-(3-chloroanilino)-9-ethyl-2-purinyl]amino]ethyl]guanidine IUPAC Name: 2-[2-[[6-(3-chloroanilino)-9-ethylpurin-2-yl]amino]ethyl]guanidine Traditional Name: 2-[2-[[6-(3-chloroanilino)-9-ethyl-purin-2-yl]amino]ethyl]guanidine Formula: C16H20ClN9 MolecularWeight: 373.8433

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)NCCN=C(N)N

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)NCCN=C(N)N

InChI

InChI=1S/C16H20ClN9/c1-2-26-9-22-12-13(23-11-5-3-4-10(17)8-11)24-16(25-14(12)26)21-7-6-20-15(18)19/h3-5,8-9H,2,6-7H2,1H3,(H4,18,19,20)(H2,21,23,24,25)