4-[(E)-N-[[2-[(4-fluorophenyl)amino]-5-phenyl-6-[(2E)-2-(1-pyridin-4-ylethylidene)hydrazinyl]pyrimidin-4-yl]amino]-C-methyl-carbonimidoyl]-N-methyl-benzenesulfonamide

Systemtic Name: 4-[(E)-N-[[2-[(4-fluorophenyl)amino]-5-phenyl-6-[(2E)-2-(1-pyridin-4-ylethylidene)hydrazinyl]pyrimidin-4-yl]amino]-C-methyl-carbonimidoyl]-N-methyl-benzenesulfonamide Openeye Name: 4-[(E)-N-[[2-(4-fluoroanilino)-5-phenyl-6-[(2E)-2-[1-(4-pyridyl)ethylidene]hydrazino]pyrimidin-4-yl]amino]-C-methyl-carbonimidoyl]-N-methyl-benzenesulfonamide CAS Name: 4-[(1E)-1-[[2-(4-fluoroanilino)-5-phenyl-6-[(2E)-2-(1-pyridin-4-ylethylidene)hydrazinyl]-4-pyrimidinyl]hydrazinylidene]ethyl]-N-methylbenzenesulfonamide IUPAC Name: 4-[(E)-N-[[2-(4-fluoroanilino)-5-phenyl-6-[(2E)-2-(1-pyridin-4-ylethylidene)hydrazinyl]pyrimidin-4-yl]amino]-C-methylcarbonimidoyl]-N-methylbenzenesulfonamide Traditional Name: 4-[(E)-N-[[2-(4-fluoroanilino)-5-phenyl-6-[(N'E)-N'-[1-(4-pyridyl)ethylidene]hydrazino]pyrimidin-4-yl]amino]-C-methyl-carbonimidoyl]-N-methyl-benzenesulfonamide Formula: C32H30FN9O2S MolecularWeight: 623.703103

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1=C(C(=NC(=N1)NC2=CC=C(C=C2)F)NN=C(C)C3=CC=NC=C3)C4=CC=CC=C4)C5=CC=C(C=C5)S(=O)(=O)NC

Isomeric SMILES

C/C(=N\NC1=C(C(=NC(=N1)NC2=CC=C(C=C2)F)N/N=C(\C)/C3=CC=NC=C3)C4=CC=CC=C4)/C5=CC=C(C=C5)S(=O)(=O)NC

InChI

InChI=1S/C32H30FN9O2S/c1-21(23-9-15-28(16-10-23)45(43,44)34-3)39-41-30-29(25-7-5-4-6-8-25)31(42-40-22(2)24-17-19-35-20-18-24)38-32(37-30)36-27-13-11-26(33)12-14-27/h4-20,34H,1-3H3,(H3,36,37,38,41,42)/b39-21+,40-22+