N-(3-chloranyl-4-methoxy-phenyl)-3-(7H-purin-6-ylamino)propanamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-3-(7H-purin-6-ylamino)propanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-3-(7H-purin-6-ylamino)propanamide CAS Name: N-(3-chloro-4-methoxyphenyl)-3-(7H-purin-6-ylamino)propanamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-3-(7H-purin-6-ylamino)propanamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-3-(7H-purin-6-ylamino)propionamide Formula: C15H15ClN6O2 MolecularWeight: 346.7716

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CCNC2=NC=NC3=C2NC=N3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CCNC2=NC=NC3=C2NC=N3)Cl

InChI

InChI=1S/C15H15ClN6O2/c1-24-11-3-2-9(6-10(11)16)22-12(23)4-5-17-14-13-15(19-7-18-13)21-8-20-14/h2-3,6-8H,4-5H2,1H3,(H,22,23)(H2,17,18,19,20,21)