N-[bis(azanyl)methylidene]-4-(4-fluoranylphenoxy)-3-methylsulfonyl-benzamide hydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-4-(4-fluoranylphenoxy)-3-methylsulfonyl-benzamide hydrochloride Openeye Name: N-(diaminomethylene)-4-(4-fluorophenoxy)-3-methylsulfonyl-benzamide hydrochloride CAS Name: N-(diaminomethylidene)-4-(4-fluorophenoxy)-3-methylsulfonylbenzamide hydrochloride IUPAC Name: N-(diaminomethylidene)-4-(4-fluorophenoxy)-3-methylsulfonylbenzamide hydrochloride Traditional Name: N-(diaminomethylene)-4-(4-fluorophenoxy)-3-mesyl-benzamide hydrochloride Formula: C15H15ClFN3O4S MolecularWeight: 387.813703

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)N=C(N)N)OC2=CC=C(C=C2)F.Cl

Isomeric SMILES

CS(=O)(=O)C1=C(C=CC(=C1)C(=O)N=C(N)N)OC2=CC=C(C=C2)F.Cl

InChI

InChI=1S/C15H14FN3O4S.ClH/c1-24(21,22)13-8-9(14(20)19-15(17)18)2-7-12(13)23-11-5-3-10(16)4-6-11;/h2-8H,1H3,(H4,17,18,19,20);1H