N-[bis(azanyl)methylidene]-1-(6-chloranylquinolin-5-yl)-5-cyclopropyl-pyrazole-4-carboxamide dihydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-1-(6-chloranylquinolin-5-yl)-5-cyclopropyl-pyrazole-4-carboxamide dihydrochloride Openeye Name: 1-(6-chloro-5-quinolyl)-5-cyclopropyl-N-(diaminomethylene)pyrazole-4-carboxamide dihydrochloride CAS Name: 1-(6-chloro-5-quinolinyl)-5-cyclopropyl-N-(diaminomethylidene)-4-pyrazolecarboxamide dihydrochloride IUPAC Name: 1-(6-chloroquinolin-5-yl)-5-cyclopropyl-N-(diaminomethylidene)pyrazole-4-carboxamide dihydrochloride Traditional Name: 1-(6-chloro-5-quinolyl)-5-cyclopropyl-N-(diaminomethylene)pyrazole-4-carboxamide dihydrochloride Formula: C17H17Cl3N6O MolecularWeight: 427.71548

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C=NN2C3=C(C=CC4=C3C=CC=N4)Cl)C(=O)N=C(N)N.Cl.Cl

Isomeric SMILES

C1CC1C2=C(C=NN2C3=C(C=CC4=C3C=CC=N4)Cl)C(=O)N=C(N)N.Cl.Cl

InChI

InChI=1S/C17H15ClN6O.2ClH/c18-12-5-6-13-10(2-1-7-21-13)15(12)24-14(9-3-4-9)11(8-22-24)16(25)23-17(19)20;;/h1-2,5-9H,3-4H2,(H4,19,20,23,25);2*1H