8-[2,4-bis(chloranyl)-5-methoxy-phenyl]sulfanyl-9-(2-propan-2-yloxyethyl)purin-6-amine

Systemtic Name: 8-[2,4-bis(chloranyl)-5-methoxy-phenyl]sulfanyl-9-(2-propan-2-yloxyethyl)purin-6-amine Openeye Name: 8-(2,4-dichloro-5-methoxy-phenyl)sulfanyl-9-(2-isopropoxyethyl)purin-6-amine CAS Name: 8-[(2,4-dichloro-5-methoxyphenyl)thio]-9-(2-propan-2-yloxyethyl)-6-purinamine IUPAC Name: 8-(2,4-dichloro-5-methoxyphenyl)sulfanyl-9-(2-propan-2-yloxyethyl)purin-6-amine Traditional Name: [8-[(2,4-dichloro-5-methoxy-phenyl)thio]-9-(2-isopropoxyethyl)purin-6-yl]amine Formula: C17H19Cl2N5O2S MolecularWeight: 428.33606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCN1C2=C(C(=NC=N2)N)N=C1SC3=C(C=C(C(=C3)OC)Cl)Cl

Isomeric SMILES

CC(C)OCCN1C2=C(C(=NC=N2)N)N=C1SC3=C(C=C(C(=C3)OC)Cl)Cl

InChI

InChI=1S/C17H19Cl2N5O2S/c1-9(2)26-5-4-24-16-14(15(20)21-8-22-16)23-17(24)27-13-7-12(25-3)10(18)6-11(13)19/h6-9H,4-5H2,1-3H3,(H2,20,21,22)