N-[4-(tert-butylsulfamoyl)phenyl]-2-(3-carbamimidoylphenyl)-5-methyl-pyrazole-3-carboxamide

Systemtic Name: N-[4-(tert-butylsulfamoyl)phenyl]-2-(3-carbamimidoylphenyl)-5-methyl-pyrazole-3-carboxamide Openeye Name: N-[4-(tert-butylsulfamoyl)phenyl]-2-(3-carbamimidoylphenyl)-5-methyl-pyrazole-3-carboxamide CAS Name: N-[4-(tert-butylsulfamoyl)phenyl]-2-(3-carbamimidoylphenyl)-5-methyl-3-pyrazolecarboxamide IUPAC Name: N-[4-(tert-butylsulfamoyl)phenyl]-2-(3-carbamimidoylphenyl)-5-methylpyrazole-3-carboxamide Traditional Name: 2-(3-amidinophenyl)-N-[4-(tert-butylsulfamoyl)phenyl]-5-methyl-pyrazole-3-carboxamide Formula: C22H26N6O3S MolecularWeight: 454.54524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC(C)(C)C)C3=CC=CC(=C3)C(=N)N

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC(C)(C)C)C3=CC=CC(=C3)C(=N)N

InChI

InChI=1S/C22H26N6O3S/c1-14-12-19(28(26-14)17-7-5-6-15(13-17)20(23)24)21(29)25-16-8-10-18(11-9-16)32(30,31)27-22(2,3)4/h5-13,27H,1-4H3,(H3,23,24)(H,25,29)