2-(3-carbamimidoylphenyl)-5-methyl-N-(4-sulfamoylphenyl)pyrazole-3-carboxamide

Systemtic Name: 2-(3-carbamimidoylphenyl)-5-methyl-N-(4-sulfamoylphenyl)pyrazole-3-carboxamide Openeye Name: 2-(3-carbamimidoylphenyl)-5-methyl-N-(4-sulfamoylphenyl)pyrazole-3-carboxamide CAS Name: 2-(3-carbamimidoylphenyl)-5-methyl-N-(4-sulfamoylphenyl)-3-pyrazolecarboxamide IUPAC Name: 2-(3-carbamimidoylphenyl)-5-methyl-N-(4-sulfamoylphenyl)pyrazole-3-carboxamide Traditional Name: 2-(3-amidinophenyl)-5-methyl-N-(4-sulfamoylphenyl)pyrazole-3-carboxamide Formula: C18H18N6O3S MolecularWeight: 398.43892

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N6O3S/c1-11-9-16(24(23-11)14-4-2-3-12(10-14)17(19)20)18(25)22-13-5-7-15(8-6-13)28(21,26)27/h2-10H,1H3,(H3,19,20)(H,22,25)(H2,21,26,27)