N-[bis(azanyl)methylidene]-4-butylsulfonyl-2-methyl-5-(trifluoromethyl)benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-butylsulfonyl-2-methyl-5-(trifluoromethyl)benzamide Openeye Name: 4-butylsulfonyl-N-(diaminomethylene)-2-methyl-5-(trifluoromethyl)benzamide CAS Name: 4-butylsulfonyl-N-(diaminomethylidene)-2-methyl-5-(trifluoromethyl)benzamide IUPAC Name: 4-butylsulfonyl-N-(diaminomethylidene)-2-methyl-5-(trifluoromethyl)benzamide Traditional Name: 4-butylsulfonyl-N-(diaminomethylene)-2-methyl-5-(trifluoromethyl)benzamide Formula: C14H18F3N3O3S MolecularWeight: 365.37123

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=C(C=C(C(=C1)C)C(=O)N=C(N)N)C(F)(F)F

Isomeric SMILES

CCCCS(=O)(=O)C1=C(C=C(C(=C1)C)C(=O)N=C(N)N)C(F)(F)F

InChI

InChI=1S/C14H18F3N3O3S/c1-3-4-5-24(22,23)11-6-8(2)9(12(21)20-13(18)19)7-10(11)14(15,16)17/h6-7H,3-5H2,1-2H3,(H4,18,19,20,21)