2-(3-azanylisoquinolin-6-yl)-5-methyl-N-[4-(2-sulfamoylphenyl)phenyl]pyrazole-3-carboxamide

Systemtic Name: 2-(3-azanylisoquinolin-6-yl)-5-methyl-N-[4-(2-sulfamoylphenyl)phenyl]pyrazole-3-carboxamide Openeye Name: 2-(3-amino-6-isoquinolyl)-5-methyl-N-[4-(2-sulfamoylphenyl)phenyl]pyrazole-3-carboxamide CAS Name: 2-(3-amino-6-isoquinolinyl)-5-methyl-N-[4-(2-sulfamoylphenyl)phenyl]-3-pyrazolecarboxamide IUPAC Name: 2-(3-aminoisoquinolin-6-yl)-5-methyl-N-[4-(2-sulfamoylphenyl)phenyl]pyrazole-3-carboxamide Traditional Name: 2-(3-amino-6-isoquinolyl)-5-methyl-N-[4-(2-sulfamoylphenyl)phenyl]pyrazole-3-carboxamide Formula: C26H22N6O3S MolecularWeight: 498.55628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N)C4=CC5=CC(=NC=C5C=C4)N

Isomeric SMILES

CC1=NN(C(=C1)C(=O)NC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)N)C4=CC5=CC(=NC=C5C=C4)N

InChI

InChI=1S/C26H22N6O3S/c1-16-12-23(32(31-16)21-11-8-18-15-29-25(27)14-19(18)13-21)26(33)30-20-9-6-17(7-10-20)22-4-2-3-5-24(22)36(28,34)35/h2-15H,1H3,(H2,27,29)(H,30,33)(H2,28,34,35)