N,N-dimethyl-3-(6-oxidanylidenepurin-2-yl)-4-propoxy-benzenesulfonamide

Systemtic Name: N,N-dimethyl-3-(6-oxidanylidenepurin-2-yl)-4-propoxy-benzenesulfonamide Openeye Name: N,N-dimethyl-3-(6-oxopurin-2-yl)-4-propoxy-benzenesulfonamide CAS Name: N,N-dimethyl-3-(6-oxo-2-purinyl)-4-propoxybenzenesulfonamide IUPAC Name: N,N-dimethyl-3-(6-oxopurin-2-yl)-4-propoxybenzenesulfonamide Traditional Name: 3-(6-ketopurin-2-yl)-N,N-dimethyl-4-propoxy-benzenesulfonamide Formula: C16H17N5O4S MolecularWeight: 375.40228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)N(C)C)C2=NC(=O)C3=NC=NC3=N2

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)N(C)C)C2=NC(=O)C3=NC=NC3=N2

InChI

InChI=1S/C16H17N5O4S/c1-4-7-25-12-6-5-10(26(23,24)21(2)3)8-11(12)14-19-15-13(16(22)20-14)17-9-18-15/h5-6,8-9H,4,7H2,1-3H3