N-[bis(azanyl)methylidene]-2-(fluoranylmethyl)-4-(4-methylphenyl)-5-methylsulfonyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-(fluoranylmethyl)-4-(4-methylphenyl)-5-methylsulfonyl-benzamide Openeye Name: N-(diaminomethylene)-2-(fluoromethyl)-5-methylsulfonyl-4-(p-tolyl)benzamide CAS Name: N-(diaminomethylidene)-2-(fluoromethyl)-4-(4-methylphenyl)-5-methylsulfonylbenzamide IUPAC Name: N-(diaminomethylidene)-2-(fluoromethyl)-4-(4-methylphenyl)-5-methylsulfonylbenzamide Traditional Name: N-(diaminomethylene)-2-(fluoromethyl)-5-mesyl-4-(p-tolyl)benzamide Formula: C17H18FN3O3S MolecularWeight: 363.406523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C(C=C2S(=O)(=O)C)C(=O)N=C(N)N)CF

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C(C=C2S(=O)(=O)C)C(=O)N=C(N)N)CF

InChI

InChI=1S/C17H18FN3O3S/c1-10-3-5-11(6-4-10)13-7-12(9-18)14(16(22)21-17(19)20)8-15(13)25(2,23)24/h3-8H,9H2,1-2H3,(H4,19,20,21,22)