1-(1,3-benzodioxol-5-yl)-N-[bis(azanyl)methylidene]-5-ethyl-pyrazole-4-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-[bis(azanyl)methylidene]-5-ethyl-pyrazole-4-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-(diaminomethylene)-5-ethyl-pyrazole-4-carboxamide CAS Name: 1-(1,3-benzodioxol-5-yl)-N-(diaminomethylidene)-5-ethyl-4-pyrazolecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-(diaminomethylidene)-5-ethylpyrazole-4-carboxamide Traditional Name: 1-(1,3-benzodioxol-5-yl)-N-(diaminomethylene)-5-ethyl-pyrazole-4-carboxamide Formula: C14H15N5O3 MolecularWeight: 301.3006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC3=C(C=C2)OCO3)C(=O)N=C(N)N

Isomeric SMILES

CCC1=C(C=NN1C2=CC3=C(C=C2)OCO3)C(=O)N=C(N)N

InChI

InChI=1S/C14H15N5O3/c1-2-10-9(13(20)18-14(15)16)6-17-19(10)8-3-4-11-12(5-8)22-7-21-11/h3-6H,2,7H2,1H3,(H4,15,16,18,20)