N-[bis(azanyl)methylidene]-5-(4-chlorophenyl)furan-2-carboxamide; methanesulfonic acid

Systemtic Name: N-[bis(azanyl)methylidene]-5-(4-chlorophenyl)furan-2-carboxamide; methanesulfonic acid Openeye Name: 5-(4-chlorophenyl)-N-(diaminomethylene)furan-2-carboxamide; methanesulfonic acid CAS Name: 5-(4-chlorophenyl)-N-(diaminomethylidene)-2-furancarboxamide; methanesulfonic acid IUPAC Name: 5-(4-chlorophenyl)-N-(diaminomethylidene)furan-2-carboxamide; methanesulfonic acid Traditional Name: 5-(4-chlorophenyl)-N-(diaminomethylene)-2-furamide; mesylic acid Formula: C13H14ClN3O5S MolecularWeight: 359.78536

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1=CC(=CC=C1C2=CC=C(O2)C(=O)N=C(N)N)Cl

Isomeric SMILES

CS(=O)(=O)O.C1=CC(=CC=C1C2=CC=C(O2)C(=O)N=C(N)N)Cl

InChI

InChI=1S/C12H10ClN3O2.CH4O3S/c13-8-3-1-7(2-4-8)9-5-6-10(18-9)11(17)16-12(14)15;1-5(2,3)4/h1-6H,(H4,14,15,16,17);1H3,(H,2,3,4)