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

Systemtic Name: 4-chloranyl-N-[4-[(2-methyl-6-propoxy-pyrimidin-4-yl)amino]phenyl]benzenesulfonamide Openeye Name: 4-chloro-N-[4-[(2-methyl-6-propoxy-pyrimidin-4-yl)amino]phenyl]benzenesulfonamide CAS Name: 4-chloro-N-[4-[(2-methyl-6-propoxy-4-pyrimidinyl)amino]phenyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[4-[(2-methyl-6-propoxypyrimidin-4-yl)amino]phenyl]benzenesulfonamide Traditional Name: 4-chloro-N-[4-[(2-methyl-6-propoxy-pyrimidin-4-yl)amino]phenyl]benzenesulfonamide Formula: C20H21ClN4O3S MolecularWeight: 432.92374

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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)Cl)C

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN4O3S/c1-3-12-28-20-13-19(22-14(2)23-20)24-16-6-8-17(9-7-16)25-29(26,27)18-10-4-15(21)5-11-18/h4-11,13,25H,3,12H2,1-2H3,(H,22,23,24)