N-[6-chloranyl-9-(3-phenylmethoxypropoxy)purin-2-yl]methanamide

Systemtic Name: N-[6-chloranyl-9-(3-phenylmethoxypropoxy)purin-2-yl]methanamide Openeye Name: N-[9-(3-benzyloxypropoxy)-6-chloro-purin-2-yl]formamide CAS Name: N-[6-chloro-9-(3-phenylmethoxypropoxy)-2-purinyl]formamide IUPAC Name: N-[6-chloro-9-(3-phenylmethoxypropoxy)purin-2-yl]formamide Traditional Name: N-[9-(3-benzoxypropoxy)-6-chloro-purin-2-yl]formamide Formula: C16H16ClN5O3 MolecularWeight: 361.78294

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCON2C=NC3=C2N=C(N=C3Cl)NC=O

Isomeric SMILES

C1=CC=C(C=C1)COCCCON2C=NC3=C2N=C(N=C3Cl)NC=O

InChI

InChI=1S/C16H16ClN5O3/c17-14-13-15(21-16(20-14)19-11-23)22(10-18-13)25-8-4-7-24-9-12-5-2-1-3-6-12/h1-3,5-6,10-11H,4,7-9H2,(H,19,20,21,23)