4-[[4-(4-pyridin-3-ylsulfonylphenyl)pyrimidin-2-yl]amino]benzamide

Systemtic Name: 4-[[4-(4-pyridin-3-ylsulfonylphenyl)pyrimidin-2-yl]amino]benzamide Openeye Name: 4-[[4-[4-(3-pyridylsulfonyl)phenyl]pyrimidin-2-yl]amino]benzamide CAS Name: 4-[[4-[4-(3-pyridinylsulfonyl)phenyl]-2-pyrimidinyl]amino]benzamide IUPAC Name: 4-[[4-(4-pyridin-3-ylsulfonylphenyl)pyrimidin-2-yl]amino]benzamide Traditional Name: 4-[[4-[4-(3-pyridylsulfonyl)phenyl]pyrimidin-2-yl]amino]benzamide Formula: C22H17N5O3S MolecularWeight: 431.46708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

C1=CC(=CN=C1)S(=O)(=O)C2=CC=C(C=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C22H17N5O3S/c23-21(28)16-3-7-17(8-4-16)26-22-25-13-11-20(27-22)15-5-9-18(10-6-15)31(29,30)19-2-1-12-24-14-19/h1-14H,(H2,23,28)(H,25,26,27)