N-methyl-4-[6-oxidanylidene-7-(phenylmethyl)-3H-purin-2-yl]benzenesulfonamide

Systemtic Name: N-methyl-4-[6-oxidanylidene-7-(phenylmethyl)-3H-purin-2-yl]benzenesulfonamide Openeye Name: 4-(7-benzyl-6-oxo-3H-purin-2-yl)-N-methyl-benzenesulfonamide CAS Name: N-methyl-4-[6-oxo-7-(phenylmethyl)-3H-purin-2-yl]benzenesulfonamide IUPAC Name: 4-(7-benzyl-6-oxo-3H-purin-2-yl)-N-methylbenzenesulfonamide Traditional Name: 4-(7-benzyl-6-keto-3H-purin-2-yl)-N-methyl-benzenesulfonamide Formula: C19H17N5O3S MolecularWeight: 395.43498

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC=C(C=C1)C2=NC(=O)C3=C(N2)N=CN3CC4=CC=CC=C4

Isomeric SMILES

CNS(=O)(=O)C1=CC=C(C=C1)C2=NC(=O)C3=C(N2)N=CN3CC4=CC=CC=C4

InChI

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