N-(3,4-dihydro-2H-chromen-4-yl)-2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanesulfonamide

Systemtic Name: N-(3,4-dihydro-2H-chromen-4-yl)-2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanesulfonamide Openeye Name: N-chroman-4-yl-2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)ethanesulfonamide CAS Name: N-(3,4-dihydro-2H-1-benzopyran-4-yl)-2-(1,3-dimethyl-2,6-dioxo-7-purinyl)ethanesulfonamide IUPAC Name: N-(3,4-dihydro-2H-chromen-4-yl)-2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethanesulfonamide Traditional Name: N-chroman-4-yl-2-(2,6-diketo-1,3-dimethyl-purin-7-yl)ethanesulfonamide Formula: C18H21N5O5S MolecularWeight: 419.45484

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCS(=O)(=O)NC3CCOC4=CC=CC=C34

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCS(=O)(=O)NC3CCOC4=CC=CC=C34

InChI

InChI=1S/C18H21N5O5S/c1-21-16-15(17(24)22(2)18(21)25)23(11-19-16)8-10-29(26,27)20-13-7-9-28-14-6-4-3-5-12(13)14/h3-6,11,13,20H,7-10H2,1-2H3