4-methoxy-N-[4-[(2-methyl-6-propoxy-pyrimidin-4-yl)amino]phenyl]benzenesulfonamide

Systemtic Name: 4-methoxy-N-[4-[(2-methyl-6-propoxy-pyrimidin-4-yl)amino]phenyl]benzenesulfonamide Openeye Name: 4-methoxy-N-[4-[(2-methyl-6-propoxy-pyrimidin-4-yl)amino]phenyl]benzenesulfonamide CAS Name: 4-methoxy-N-[4-[(2-methyl-6-propoxy-4-pyrimidinyl)amino]phenyl]benzenesulfonamide IUPAC Name: 4-methoxy-N-[4-[(2-methyl-6-propoxypyrimidin-4-yl)amino]phenyl]benzenesulfonamide Traditional Name: 4-methoxy-N-[4-[(2-methyl-6-propoxy-pyrimidin-4-yl)amino]phenyl]benzenesulfonamide Formula: C21H24N4O4S MolecularWeight: 428.50466

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NC(=NC(=C1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CCCOC1=NC(=NC(=C1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C21H24N4O4S/c1-4-13-29-21-14-20(22-15(2)23-21)24-16-5-7-17(8-6-16)25-30(26,27)19-11-9-18(28-3)10-12-19/h5-12,14,25H,4,13H2,1-3H3,(H,22,23,24)