4-(4-aminophenyl)sulfonylaniline; 5-methyl-2-phenyl-1H-pyrazol-3-one

Systemtic Name: 4-(4-aminophenyl)sulfonylaniline; 5-methyl-2-phenyl-1H-pyrazol-3-one Openeye Name: 4-(4-aminophenyl)sulfonylaniline; 5-methyl-2-phenyl-1H-pyrazol-3-one CAS Name: 4-(4-aminophenyl)sulfonylaniline; 5-methyl-2-phenyl-1H-pyrazol-3-one IUPAC Name: 4-(4-aminophenyl)sulfonylaniline; 5-methyl-2-phenyl-1H-pyrazol-3-one Traditional Name: 5-methyl-2-phenyl-3-pyrazolin-3-one; (4-sulfanilylphenyl)amine Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1)C2=CC=CC=C2.C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)N

Isomeric SMILES

CC1=CC(=O)N(N1)C2=CC=CC=C2.C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)N

InChI

InChI=1S/C12H12N2O2S.C10H10N2O/c13-9-1-5-11(6-2-9)17(15,16)12-7-3-10(14)4-8-12;1-8-7-10(13)12(11-8)9-5-3-2-4-6-9/h1-8H,13-14H2;2-7,11H,1H3