N-[bis(azanyl)methylidene]-1-(2-chloranyl-5-iodanyl-phenyl)-5-cyclopropyl-pyrazole-4-carboxamide hydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-1-(2-chloranyl-5-iodanyl-phenyl)-5-cyclopropyl-pyrazole-4-carboxamide hydrochloride Openeye Name: 1-(2-chloro-5-iodo-phenyl)-5-cyclopropyl-N-(diaminomethylene)pyrazole-4-carboxamide hydrochloride CAS Name: 1-(2-chloro-5-iodophenyl)-5-cyclopropyl-N-(diaminomethylidene)-4-pyrazolecarboxamide hydrochloride IUPAC Name: 1-(2-chloro-5-iodophenyl)-5-cyclopropyl-N-(diaminomethylidene)pyrazole-4-carboxamide hydrochloride Traditional Name: 1-(2-chloro-5-iodo-phenyl)-5-cyclopropyl-N-(diaminomethylene)pyrazole-4-carboxamide hydrochloride Formula: C14H14Cl2IN5O MolecularWeight: 466.10433

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=C(C=NN2C3=C(C=CC(=C3)I)Cl)C(=O)N=C(N)N.Cl

Isomeric SMILES

C1CC1C2=C(C=NN2C3=C(C=CC(=C3)I)Cl)C(=O)N=C(N)N.Cl

InChI

InChI=1S/C14H13ClIN5O.ClH/c15-10-4-3-8(16)5-11(10)21-12(7-1-2-7)9(6-19-21)13(22)20-14(17)18;/h3-7H,1-2H2,(H4,17,18,20,22);1H