N-[bis(azanyl)methylidene]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide; methanesulfonic acid

Systemtic Name: N-[bis(azanyl)methylidene]-2-(3,4-dimethylphenyl)quinoline-4-carboxamide; methanesulfonic acid Openeye Name: N-(diaminomethylene)-2-(3,4-dimethylphenyl)quinoline-4-carboxamide; methanesulfonic acid CAS Name: N-(diaminomethylidene)-2-(3,4-dimethylphenyl)-4-quinolinecarboxamide; methanesulfonic acid IUPAC Name: N-(diaminomethylidene)-2-(3,4-dimethylphenyl)quinoline-4-carboxamide; methanesulfonic acid Traditional Name: N-(diaminomethylene)-2-(3,4-dimethylphenyl)cinchoninamide; mesylic acid Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N=C(N)N)C.CS(=O)(=O)O

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N=C(N)N)C.CS(=O)(=O)O

InChI

InChI=1S/C19H18N4O.CH4O3S/c1-11-7-8-13(9-12(11)2)17-10-15(18(24)23-19(20)21)14-5-3-4-6-16(14)22-17;1-5(2,3)4/h3-10H,1-2H3,(H4,20,21,23,24);1H3,(H,2,3,4)