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

Systemtic Name: N-[bis(azanyl)methylidene]-2-(2-chlorophenyl)quinoline-4-carboxamide; methanesulfonic acid Openeye Name: 2-(2-chlorophenyl)-N-(diaminomethylene)quinoline-4-carboxamide; methanesulfonic acid CAS Name: 2-(2-chlorophenyl)-N-(diaminomethylidene)-4-quinolinecarboxamide; methanesulfonic acid IUPAC Name: 2-(2-chlorophenyl)-N-(diaminomethylidene)quinoline-4-carboxamide; methanesulfonic acid Traditional Name: 2-(2-chlorophenyl)-N-(diaminomethylene)cinchoninamide; mesylic acid Formula: C18H17ClN4O4S MolecularWeight: 420.86998

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CC=C3Cl)C(=O)N=C(N)N

Isomeric SMILES

CS(=O)(=O)O.C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CC=C3Cl)C(=O)N=C(N)N

InChI

InChI=1S/C17H13ClN4O.CH4O3S/c18-13-7-3-1-6-11(13)15-9-12(16(23)22-17(19)20)10-5-2-4-8-14(10)21-15;1-5(2,3)4/h1-9H,(H4,19,20,22,23);1H3,(H,2,3,4)