4-[5-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-2,3-dimethoxy-phenyl]benzenesulfonamide

Systemtic Name: 4-[5-[[2,4-bis(azanyl)pyrimidin-5-yl]methyl]-2,3-dimethoxy-phenyl]benzenesulfonamide Openeye Name: 4-[5-[(2,4-diaminopyrimidin-5-yl)methyl]-2,3-dimethoxy-phenyl]benzenesulfonamide CAS Name: 4-[5-[(2,4-diamino-5-pyrimidinyl)methyl]-2,3-dimethoxyphenyl]benzenesulfonamide IUPAC Name: 4-[5-[(2,4-diaminopyrimidin-5-yl)methyl]-2,3-dimethoxyphenyl]benzenesulfonamide Traditional Name: 4-[5-[(2,4-diaminopyrimidin-5-yl)methyl]-2,3-dimethoxy-phenyl]benzenesulfonamide Formula: C19H21N5O4S MolecularWeight: 415.46614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CC2=CN=C(N=C2N)N)C3=CC=C(C=C3)S(=O)(=O)N)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)CC2=CN=C(N=C2N)N)C3=CC=C(C=C3)S(=O)(=O)N)OC

InChI

InChI=1S/C19H21N5O4S/c1-27-16-9-11(7-13-10-23-19(21)24-18(13)20)8-15(17(16)28-2)12-3-5-14(6-4-12)29(22,25)26/h3-6,8-10H,7H2,1-2H3,(H2,22,25,26)(H4,20,21,23,24)