5-(3-azanyl-4-methyl-phenyl)-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)pyrazole

Systemtic Name: 5-(3-azanyl-4-methyl-phenyl)-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)pyrazole Openeye Name: 5-(3-amino-4-methyl-phenyl)-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)pyrazole CAS Name: 5-(3-amino-4-methylphenyl)-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)pyrazole IUPAC Name: 5-(3-amino-4-methylphenyl)-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)pyrazole Traditional Name: 5-(3-amino-4-methyl-phenyl)-1-(4-sulfinamoyloxyphenyl)-3-(trifluoromethyl)pyrazole Formula: C17H15F3N4O2S MolecularWeight: 396.38681

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)OS(=O)N)C(F)(F)F)N

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)OS(=O)N)C(F)(F)F)N

InChI

InChI=1S/C17H15F3N4O2S/c1-10-2-3-11(8-14(10)21)15-9-16(17(18,19)20)23-24(15)12-4-6-13(7-5-12)26-27(22)25/h2-9H,21-22H2,1H3