N-[1-(cyclopropylmethyl)-7-methyl-2,6-bis(oxidanylidene)-3H-purin-8-yl]-4-methoxy-benzenesulfonamide

Systemtic Name: N-[1-(cyclopropylmethyl)-7-methyl-2,6-bis(oxidanylidene)-3H-purin-8-yl]-4-methoxy-benzenesulfonamide Openeye Name: N-[1-(cyclopropylmethyl)-7-methyl-2,6-dioxo-3H-purin-8-yl]-4-methoxy-benzenesulfonamide CAS Name: N-[1-(cyclopropylmethyl)-7-methyl-2,6-dioxo-3H-purin-8-yl]-4-methoxybenzenesulfonamide IUPAC Name: N-[1-(cyclopropylmethyl)-7-methyl-2,6-dioxo-3H-purin-8-yl]-4-methoxybenzenesulfonamide Traditional Name: N-[1-(cyclopropylmethyl)-2,6-diketo-7-methyl-3H-purin-8-yl]-4-methoxy-benzenesulfonamide Formula: C17H19N5O5S MolecularWeight: 405.42826

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(NC(=O)N(C2=O)CC3CC3)N=C1NS(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CN1C2=C(NC(=O)N(C2=O)CC3CC3)N=C1NS(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C17H19N5O5S/c1-21-13-14(19-17(24)22(15(13)23)9-10-3-4-10)18-16(21)20-28(25,26)12-7-5-11(27-2)6-8-12/h5-8,10H,3-4,9H2,1-2H3,(H,18,20)(H,19,24)