4-methyl-1-(4-sulfamoylphenyl)-4H-thiochromeno[4,3-c]pyrazole-3-carboxylate

Systemtic Name: 4-methyl-1-(4-sulfamoylphenyl)-4H-thiochromeno[4,3-c]pyrazole-3-carboxylate Openeye Name: 4-methyl-1-(4-sulfamoylphenyl)-4H-thiochromeno[4,3-c]pyrazole-3-carboxylate CAS Name: 4-methyl-1-(4-sulfamoylphenyl)-4H-thiochromeno[4,3-c]pyrazole-3-carboxylate IUPAC Name: 4-methyl-1-(4-sulfamoylphenyl)-4H-thiochromeno[4,3-c]pyrazole-3-carboxylate Traditional Name: 4-methyl-1-(4-sulfamoylphenyl)-4H-thiochromeno[4,3-c]pyrazole-3-carboxylate Formula: C18H14N3O4S2- MolecularWeight: 400.45146

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(C3=CC=CC=C3S1)N(N=C2C(=O)[O-])C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CC1C2=C(C3=CC=CC=C3S1)N(N=C2C(=O)[O-])C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C18H15N3O4S2/c1-10-15-16(18(22)23)20-21(11-6-8-12(9-7-11)27(19,24)25)17(15)13-4-2-3-5-14(13)26-10/h2-10H,1H3,(H,22,23)(H2,19,24,25)/p-1