8-(3-methoxyphenyl)sulfonyl-9-(2-propan-2-yloxyethyl)purin-6-amine

Systemtic Name: 8-(3-methoxyphenyl)sulfonyl-9-(2-propan-2-yloxyethyl)purin-6-amine Openeye Name: 9-(2-isopropoxyethyl)-8-(3-methoxyphenyl)sulfonyl-purin-6-amine CAS Name: 8-(3-methoxyphenyl)sulfonyl-9-(2-propan-2-yloxyethyl)-6-purinamine IUPAC Name: 8-(3-methoxyphenyl)sulfonyl-9-(2-propan-2-yloxyethyl)purin-6-amine Traditional Name: [9-(2-isopropoxyethyl)-8-(3-methoxyphenyl)sulfonyl-purin-6-yl]amine Formula: C17H21N5O4S MolecularWeight: 391.44474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCN1C2=C(C(=NC=N2)N)N=C1S(=O)(=O)C3=CC=CC(=C3)OC

Isomeric SMILES

CC(C)OCCN1C2=C(C(=NC=N2)N)N=C1S(=O)(=O)C3=CC=CC(=C3)OC

InChI

InChI=1S/C17H21N5O4S/c1-11(2)26-8-7-22-16-14(15(18)19-10-20-16)21-17(22)27(23,24)13-6-4-5-12(9-13)25-3/h4-6,9-11H,7-8H2,1-3H3,(H2,18,19,20)