2-(3-carbamimidoylphenyl)-5-methyl-N-[2-[4-(sulfonylmethyl)phenoxy]phenyl]pyrazole-3-carboxamide

Systemtic Name: 2-(3-carbamimidoylphenyl)-5-methyl-N-[2-[4-(sulfonylmethyl)phenoxy]phenyl]pyrazole-3-carboxamide Openeye Name: 2-(3-carbamimidoylphenyl)-5-methyl-N-[2-[4-(sulfonylmethyl)phenoxy]phenyl]pyrazole-3-carboxamide CAS Name: 2-(3-carbamimidoylphenyl)-5-methyl-N-[2-[4-(sulfonylmethyl)phenoxy]phenyl]-3-pyrazolecarboxamide IUPAC Name: 2-(3-carbamimidoylphenyl)-5-methyl-N-[2-[4-(sulfonylmethyl)phenoxy]phenyl]pyrazole-3-carboxamide Traditional Name: 2-(3-amidinophenyl)-5-methyl-N-[2-[4-(sulfonylmethyl)phenoxy]phenyl]pyrazole-3-carboxamide Formula: C25H21N5O4S MolecularWeight: 487.53034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=CC=CC=C2OC3=CC=C(C=C3)C=S(=O)=O)C4=CC=CC(=C4)C(=N)N

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=CC=CC=C2OC3=CC=C(C=C3)C=S(=O)=O)C4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C25H21N5O4S/c1-16-13-22(30(29-16)19-6-4-5-18(14-19)24(26)27)25(31)28-21-7-2-3-8-23(21)34-20-11-9-17(10-12-20)15-35(32)33/h2-15H,1H3,(H3,26,27)(H,28,31)