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

Systemtic Name: N,N-bis(2-hydroxyethyl)-3-[1-methyl-2,6-bis(oxidanylidene)-3-propyl-7H-purin-8-yl]-4-propoxy-benzenesulfonamide Openeye Name: N,N-bis(2-hydroxyethyl)-3-(1-methyl-2,6-dioxo-3-propyl-7H-purin-8-yl)-4-propoxy-benzenesulfonamide CAS Name: N,N-bis(2-hydroxyethyl)-3-(1-methyl-2,6-dioxo-3-propyl-7H-purin-8-yl)-4-propoxybenzenesulfonamide IUPAC Name: N,N-bis(2-hydroxyethyl)-3-(1-methyl-2,6-dioxo-3-propyl-7H-purin-8-yl)-4-propoxybenzenesulfonamide Traditional Name: 3-(2,6-diketo-1-methyl-3-propyl-7H-purin-8-yl)-N,N-bis(2-hydroxyethyl)-4-propoxy-benzenesulfonamide Formula: C22H31N5O7S MolecularWeight: 509.57584

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=C(C=CC(=C3)S(=O)(=O)N(CCO)CCO)OCCC

Isomeric SMILES

CCCN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=C(C=CC(=C3)S(=O)(=O)N(CCO)CCO)OCCC

InChI

InChI=1S/C22H31N5O7S/c1-4-8-27-20-18(21(30)25(3)22(27)31)23-19(24-20)16-14-15(6-7-17(16)34-13-5-2)35(32,33)26(9-11-28)10-12-29/h6-7,14,28-29H,4-5,8-13H2,1-3H3,(H,23,24)