3-[[4-[[2-methyl-5-(methylsulfonylamino)phenyl]amino]pyrimidin-2-yl]amino]benzamide

Systemtic Name: 3-[[4-[[2-methyl-5-(methylsulfonylamino)phenyl]amino]pyrimidin-2-yl]amino]benzamide Openeye Name: 3-[[4-[5-(methanesulfonamido)-2-methyl-anilino]pyrimidin-2-yl]amino]benzamide CAS Name: 3-[[4-[5-(methanesulfonamido)-2-methylanilino]-2-pyrimidinyl]amino]benzamide IUPAC Name: 3-[[4-[5-(methanesulfonamido)-2-methylanilino]pyrimidin-2-yl]amino]benzamide Traditional Name: 3-[[4-[5-(methanesulfonamido)-2-methyl-anilino]pyrimidin-2-yl]amino]benzamide Formula: C19H20N6O3S MolecularWeight: 412.4655

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NS(=O)(=O)C)NC2=NC(=NC=C2)NC3=CC=CC(=C3)C(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)NS(=O)(=O)C)NC2=NC(=NC=C2)NC3=CC=CC(=C3)C(=O)N

InChI

InChI=1S/C19H20N6O3S/c1-12-6-7-15(25-29(2,27)28)11-16(12)23-17-8-9-21-19(24-17)22-14-5-3-4-13(10-14)18(20)26/h3-11,25H,1-2H3,(H2,20,26)(H2,21,22,23,24)