2-(6-carbamimidoylpyridin-2-yl)-N-[2-fluoranyl-6-(2-methylsulfonylphenyl)phenyl]-5-methyl-pyrazole-3-carboxamide

Systemtic Name: 2-(6-carbamimidoylpyridin-2-yl)-N-[2-fluoranyl-6-(2-methylsulfonylphenyl)phenyl]-5-methyl-pyrazole-3-carboxamide Openeye Name: 2-(6-carbamimidoyl-2-pyridyl)-N-[2-fluoro-6-(2-methylsulfonylphenyl)phenyl]-5-methyl-pyrazole-3-carboxamide CAS Name: 2-(6-carbamimidoyl-2-pyridinyl)-N-[2-fluoro-6-(2-methylsulfonylphenyl)phenyl]-5-methyl-3-pyrazolecarboxamide IUPAC Name: 2-(6-carbamimidoylpyridin-2-yl)-N-[2-fluoro-6-(2-methylsulfonylphenyl)phenyl]-5-methylpyrazole-3-carboxamide Traditional Name: 2-(6-amidino-2-pyridyl)-N-[2-fluoro-6-(2-mesylphenyl)phenyl]-5-methyl-pyrazole-3-carboxamide Formula: C24H21FN6O3S MolecularWeight: 492.525343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=C(C=CC=C2F)C3=CC=CC=C3S(=O)(=O)C)C4=CC=CC(=N4)C(=N)N

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=C(C=CC=C2F)C3=CC=CC=C3S(=O)(=O)C)C4=CC=CC(=N4)C(=N)N

InChI

InChI=1S/C24H21FN6O3S/c1-14-13-19(31(30-14)21-12-6-10-18(28-21)23(26)27)24(32)29-22-16(8-5-9-17(22)25)15-7-3-4-11-20(15)35(2,33)34/h3-13H,1-2H3,(H3,26,27)(H,29,32)