N-[bis(azanyl)methylidene]-2-(tert-butylcarbamoylamino)-5-chloranyl-benzamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-(tert-butylcarbamoylamino)-5-chloranyl-benzamide Openeye Name: 2-(tert-butylcarbamoylamino)-5-chloro-N-(diaminomethylene)benzamide CAS Name: 2-[[(tert-butylamino)-oxomethyl]amino]-5-chloro-N-(diaminomethylidene)benzamide IUPAC Name: 2-(tert-butylcarbamoylamino)-5-chloro-N-(diaminomethylidene)benzamide Traditional Name: 2-(tert-butylcarbamoylamino)-5-chloro-N-(diaminomethylene)benzamide Formula: C13H18ClN5O2 MolecularWeight: 311.76732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC1=C(C=C(C=C1)Cl)C(=O)N=C(N)N

Isomeric SMILES

CC(C)(C)NC(=O)NC1=C(C=C(C=C1)Cl)C(=O)N=C(N)N

InChI

InChI=1S/C13H18ClN5O2/c1-13(2,3)19-12(21)17-9-5-4-7(14)6-8(9)10(20)18-11(15)16/h4-6H,1-3H3,(H2,17,19,21)(H4,15,16,18,20)