2-(3-carbamimidoylphenyl)-N-[2-fluoranyl-4-(2-methylsulfonylphenyl)phenyl]-5-methyl-pyrazole-3-carboxamide

Systemtic Name: 2-(3-carbamimidoylphenyl)-N-[2-fluoranyl-4-(2-methylsulfonylphenyl)phenyl]-5-methyl-pyrazole-3-carboxamide Openeye Name: 2-(3-carbamimidoylphenyl)-N-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-5-methyl-pyrazole-3-carboxamide CAS Name: 2-(3-carbamimidoylphenyl)-N-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-5-methyl-3-pyrazolecarboxamide IUPAC Name: 2-(3-carbamimidoylphenyl)-N-[2-fluoro-4-(2-methylsulfonylphenyl)phenyl]-5-methylpyrazole-3-carboxamide Traditional Name: 2-(3-amidinophenyl)-N-[2-fluoro-4-(2-mesylphenyl)phenyl]-5-methyl-pyrazole-3-carboxamide Formula: C25H22FN5O3S MolecularWeight: 491.537283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=C(C=C(C=C2)C3=CC=CC=C3S(=O)(=O)C)F)C4=CC=CC(=C4)C(=N)N

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=C(C=C(C=C2)C3=CC=CC=C3S(=O)(=O)C)F)C4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C25H22FN5O3S/c1-15-12-22(31(30-15)18-7-5-6-17(13-18)24(27)28)25(32)29-21-11-10-16(14-20(21)26)19-8-3-4-9-23(19)35(2,33)34/h3-14H,1-2H3,(H3,27,28)(H,29,32)