4-(4-azanylpiperidin-1-yl)-N-[bis(azanyl)methylidene]-5-methylsulfonyl-2-(trifluoromethyl)benzamide

Systemtic Name: 4-(4-azanylpiperidin-1-yl)-N-[bis(azanyl)methylidene]-5-methylsulfonyl-2-(trifluoromethyl)benzamide Openeye Name: 4-(4-amino-1-piperidyl)-N-(diaminomethylene)-5-methylsulfonyl-2-(trifluoromethyl)benzamide CAS Name: 4-(4-amino-1-piperidinyl)-N-(diaminomethylidene)-5-methylsulfonyl-2-(trifluoromethyl)benzamide IUPAC Name: 4-(4-aminopiperidin-1-yl)-N-(diaminomethylidene)-5-methylsulfonyl-2-(trifluoromethyl)benzamide Traditional Name: 4-(4-aminopiperidino)-N-(diaminomethylene)-5-mesyl-2-(trifluoromethyl)benzamide Formula: C15H20F3N5O3S MolecularWeight: 407.41121

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=C(C(=C1)C(=O)N=C(N)N)C(F)(F)F)N2CCC(CC2)N

Isomeric SMILES

CS(=O)(=O)C1=C(C=C(C(=C1)C(=O)N=C(N)N)C(F)(F)F)N2CCC(CC2)N

InChI

InChI=1S/C15H20F3N5O3S/c1-27(25,26)12-6-9(13(24)22-14(20)21)10(15(16,17)18)7-11(12)23-4-2-8(19)3-5-23/h6-8H,2-5,19H2,1H3,(H4,20,21,22,24)