2-[(4-cyclohexylphenyl)sulfonylamino]-7H-purin-6-olate

Systemtic Name: 2-[(4-cyclohexylphenyl)sulfonylamino]-7H-purin-6-olate Openeye Name: 2-[(4-cyclohexylphenyl)sulfonylamino]-7H-purin-6-olate CAS Name: 2-[(4-cyclohexylphenyl)sulfonylamino]-7H-purin-6-olate IUPAC Name: 2-[(4-cyclohexylphenyl)sulfonylamino]-7H-purin-6-olate Traditional Name: 2-[(4-cyclohexylphenyl)sulfonylamino]-7H-purin-6-olate Formula: C17H18N5O3S- MolecularWeight: 372.42152

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)S(=O)(=O)NC3=NC4=C(C(=N3)[O-])NC=N4

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)S(=O)(=O)NC3=NC4=C(C(=N3)[O-])NC=N4

InChI

InChI=1S/C17H19N5O3S/c23-16-14-15(19-10-18-14)20-17(21-16)22-26(24,25)13-8-6-12(7-9-13)11-4-2-1-3-5-11/h6-11H,1-5H2,(H3,18,19,20,21,22,23)/p-1