1-(phenylmethyl)-7,8-dihydro-[1,3]thiazolo[2,3-f]purin-6-ium

Systemtic Name: 1-(phenylmethyl)-7,8-dihydro-[1,3]thiazolo[2,3-f]purin-6-ium Openeye Name: 1-benzyl-7,8-dihydrothiazolo[2,3-f]purin-6-ium CAS Name: 1-(phenylmethyl)-7,8-dihydrothiazolo[2,3-f]purin-6-ium IUPAC Name: 1-benzyl-7,8-dihydro-[1,3]thiazolo[2,3-f]purin-6-ium Traditional Name: 1-benzyl-7,8-dihydrothiazolo[2,3-f]purin-6-ium Formula: C14H13N4S+ MolecularWeight: 269.34482

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=[N+]1C=NC3=C2N(C=N3)CC4=CC=CC=C4

Isomeric SMILES

C1CSC2=[N+]1C=NC3=C2N(C=N3)CC4=CC=CC=C4

InChI

InChI=1S/C14H13N4S/c1-2-4-11(5-3-1)8-18-10-16-13-12(18)14-17(9-15-13)6-7-19-14/h1-5,9-10H,6-8H2/q+1