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

Systemtic Name: 6-chloranyl-9-(phenylmethyl)-2-thiophen-2-yl-purine Openeye Name: 9-benzyl-6-chloro-2-(2-thienyl)purine CAS Name: 6-chloro-9-(phenylmethyl)-2-thiophen-2-ylpurine IUPAC Name: 9-benzyl-6-chloro-2-thiophen-2-ylpurine Traditional Name: 9-benzyl-6-chloro-2-(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=C2N=C(N=C3Cl)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2N=C(N=C3Cl)C4=CC=CS4

InChI

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