N-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methyl]-N-(2-hydroxyethyl)-4-methyl-benzenesulfonamide

Systemtic Name: N-[(2-azanyl-6-oxidanylidene-3H-purin-9-yl)methyl]-N-(2-hydroxyethyl)-4-methyl-benzenesulfonamide Openeye Name: N-[(2-amino-6-oxo-3H-purin-9-yl)methyl]-N-(2-hydroxyethyl)-4-methyl-benzenesulfonamide CAS Name: N-[(2-amino-6-oxo-3H-purin-9-yl)methyl]-N-(2-hydroxyethyl)-4-methylbenzenesulfonamide IUPAC Name: N-[(2-amino-6-oxo-3H-purin-9-yl)methyl]-N-(2-hydroxyethyl)-4-methylbenzenesulfonamide Traditional Name: N-[(2-amino-6-keto-3H-purin-9-yl)methyl]-N-(2-hydroxyethyl)-4-methyl-benzenesulfonamide Formula: C15H18N6O4S MolecularWeight: 378.40622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCO)CN2C=NC3=C2NC(=NC3=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCO)CN2C=NC3=C2NC(=NC3=O)N

InChI

InChI=1S/C15H18N6O4S/c1-10-2-4-11(5-3-10)26(24,25)21(6-7-22)9-20-8-17-12-13(20)18-15(16)19-14(12)23/h2-5,8,22H,6-7,9H2,1H3,(H3,16,18,19,23)