2-chloranyl-9-(phenylmethyl)-6-thiophen-2-yl-purine

Systemtic Name: 2-chloranyl-9-(phenylmethyl)-6-thiophen-2-yl-purine Openeye Name: 9-benzyl-2-chloro-6-(2-thienyl)purine CAS Name: 2-chloro-9-(phenylmethyl)-6-thiophen-2-ylpurine IUPAC Name: 9-benzyl-2-chloro-6-thiophen-2-ylpurine Traditional Name: 9-benzyl-2-chloro-6-(2-thienyl)purine Formula: C16H11ClN4S MolecularWeight: 326.80334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C(N=C(N=C32)Cl)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C(N=C(N=C32)Cl)C4=CC=CS4

InChI

InChI=1S/C16H11ClN4S/c17-16-19-13(12-7-4-8-22-12)14-15(20-16)21(10-18-14)9-11-5-2-1-3-6-11/h1-8,10H,9H2