2-[[4-cyano-3-[[4-(dimethylsulfamoylamino)phenyl]methoxy]phenyl]amino]pyrimidine-4-carboxamide

Systemtic Name: 2-[[4-cyano-3-[[4-(dimethylsulfamoylamino)phenyl]methoxy]phenyl]amino]pyrimidine-4-carboxamide Openeye Name: 2-[4-cyano-3-[[4-(dimethylsulfamoylamino)phenyl]methoxy]anilino]pyrimidine-4-carboxamide CAS Name: 2-[4-cyano-3-[[4-(dimethylsulfamoylamino)phenyl]methoxy]anilino]-4-pyrimidinecarboxamide IUPAC Name: 2-[4-cyano-3-[[4-(dimethylsulfamoylamino)phenyl]methoxy]anilino]pyrimidine-4-carboxamide Traditional Name: 2-[4-cyano-3-[4-(dimethylsulfamoylamino)benzyl]oxy-anilino]pyrimidine-4-carboxamide Formula: C21H21N7O4S MolecularWeight: 467.50094

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)NC1=CC=C(C=C1)COC2=C(C=CC(=C2)NC3=NC=CC(=N3)C(=O)N)C#N

Isomeric SMILES

CN(C)S(=O)(=O)NC1=CC=C(C=C1)COC2=C(C=CC(=C2)NC3=NC=CC(=N3)C(=O)N)C#N

InChI

InChI=1S/C21H21N7O4S/c1-28(2)33(30,31)27-16-6-3-14(4-7-16)13-32-19-11-17(8-5-15(19)12-22)25-21-24-10-9-18(26-21)20(23)29/h3-11,27H,13H2,1-2H3,(H2,23,29)(H,24,25,26)