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

Systemtic Name: 4-[(E)-C-methyl-N-[methyl-[5-phenyl-2-phenylazanyl-6-(4-pyridin-4-ylpyrazol-1-yl)pyrimidin-4-yl]amino]carbonimidoyl]benzenesulfonamide Openeye Name: 4-[(E)-N-[[2-anilino-5-phenyl-6-[4-(4-pyridyl)pyrazol-1-yl]pyrimidin-4-yl]-methyl-amino]-C-methyl-carbonimidoyl]benzenesulfonamide CAS Name: 4-[(1E)-1-[[2-anilino-5-phenyl-6-(4-pyridin-4-yl-1-pyrazolyl)-4-pyrimidinyl]-methylhydrazinylidene]ethyl]benzenesulfonamide IUPAC Name: 4-[(E)-N-[[2-anilino-5-phenyl-6-(4-pyridin-4-ylpyrazol-1-yl)pyrimidin-4-yl]-methylamino]-C-methylcarbonimidoyl]benzenesulfonamide Traditional Name: 4-[(E)-N-[[2-anilino-5-phenyl-6-[4-(4-pyridyl)pyrazol-1-yl]pyrimidin-4-yl]-methyl-amino]-C-methyl-carbonimidoyl]benzenesulfonamide Formula: C33H29N9O2S MolecularWeight: 615.70746

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN(C)C1=NC(=NC(=C1C2=CC=CC=C2)N3C=C(C=N3)C4=CC=NC=C4)NC5=CC=CC=C5)C6=CC=C(C=C6)S(=O)(=O)N

Isomeric SMILES

C/C(=N\N(C)C1=NC(=NC(=C1C2=CC=CC=C2)N3C=C(C=N3)C4=CC=NC=C4)NC5=CC=CC=C5)/C6=CC=C(C=C6)S(=O)(=O)N

InChI

InChI=1S/C33H29N9O2S/c1-23(24-13-15-29(16-14-24)45(34,43)44)40-41(2)31-30(26-9-5-3-6-10-26)32(39-33(38-31)37-28-11-7-4-8-12-28)42-22-27(21-36-42)25-17-19-35-20-18-25/h3-22H,1-2H3,(H2,34,43,44)(H,37,38,39)/b40-23+