9-(4-methylphenyl)sulfonyl-6-phenylmethoxy-purin-2-amine

Systemtic Name: 9-(4-methylphenyl)sulfonyl-6-phenylmethoxy-purin-2-amine Openeye Name: 6-benzyloxy-9-(p-tolylsulfonyl)purin-2-amine CAS Name: 9-(4-methylphenyl)sulfonyl-6-phenylmethoxy-2-purinamine IUPAC Name: 9-(4-methylphenyl)sulfonyl-6-phenylmethoxypurin-2-amine Traditional Name: (6-benzoxy-9-tosyl-purin-2-yl)amine Formula: C19H17N5O3S MolecularWeight: 395.43498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=NC3=C2N=C(N=C3OCC4=CC=CC=C4)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=NC3=C2N=C(N=C3OCC4=CC=CC=C4)N

InChI

InChI=1S/C19H17N5O3S/c1-13-7-9-15(10-8-13)28(25,26)24-12-21-16-17(24)22-19(20)23-18(16)27-11-14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H2,20,22,23)