6-chloranyl-9-[6-[(2-fluorophenyl)sulfanylmethyl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purine

Systemtic Name: 6-chloranyl-9-[6-[(2-fluorophenyl)sulfanylmethyl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purine Openeye Name: 6-chloro-9-[6-[(2-fluorophenyl)sulfanylmethyl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purine CAS Name: 6-chloro-9-[6-[[(2-fluorophenyl)thio]methyl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purine IUPAC Name: 6-chloro-9-[6-[(2-fluorophenyl)sulfanylmethyl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purine Traditional Name: 6-chloro-9-[6-[[(2-fluorophenyl)thio]methyl]-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]purine Formula: C19H18ClFN4O3S MolecularWeight: 436.887623

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2C(OC(C2O1)N3C=NC4=C3N=CN=C4Cl)CSC5=CC=CC=C5F)C

Isomeric SMILES

CC1(OC2C(OC(C2O1)N3C=NC4=C3N=CN=C4Cl)CSC5=CC=CC=C5F)C

InChI

InChI=1S/C19H18ClFN4O3S/c1-19(2)27-14-11(7-29-12-6-4-3-5-10(12)21)26-18(15(14)28-19)25-9-24-13-16(20)22-8-23-17(13)25/h3-6,8-9,11,14-15,18H,7H2,1-2H3