5-[[4-[[4-(cyanomethoxy)phenyl]amino]-5-methyl-pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide

Systemtic Name: 5-[[4-[[4-(cyanomethoxy)phenyl]amino]-5-methyl-pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide Openeye Name: 5-[[4-[4-(cyanomethoxy)anilino]-5-methyl-pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide CAS Name: 5-[[4-[4-(cyanomethoxy)anilino]-5-methyl-2-pyrimidinyl]amino]-2-methylbenzenesulfonamide IUPAC Name: 5-[[4-[4-(cyanomethoxy)anilino]-5-methylpyrimidin-2-yl]amino]-2-methylbenzenesulfonamide Traditional Name: 5-[[4-[4-(cyanomethoxy)anilino]-5-methyl-pyrimidin-2-yl]amino]-2-methyl-benzenesulfonamide Formula: C20H20N6O3S MolecularWeight: 424.4762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=C(C=C3)OCC#N)C)S(=O)(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC=C(C(=N2)NC3=CC=C(C=C3)OCC#N)C)S(=O)(=O)N

InChI

InChI=1S/C20H20N6O3S/c1-13-3-4-16(11-18(13)30(22,27)28)25-20-23-12-14(2)19(26-20)24-15-5-7-17(8-6-15)29-10-9-21/h3-8,11-12H,10H2,1-2H3,(H2,22,27,28)(H2,23,24,25,26)