N-[bis(azanyl)methylidene]-4-chloranyl-3-(propylcarbamoylamino)benzamide hydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-4-chloranyl-3-(propylcarbamoylamino)benzamide hydrochloride Openeye Name: 4-chloro-N-(diaminomethylene)-3-(propylcarbamoylamino)benzamide hydrochloride CAS Name: 4-chloro-N-(diaminomethylidene)-3-[[oxo(propylamino)methyl]amino]benzamide hydrochloride IUPAC Name: 4-chloro-N-(diaminomethylidene)-3-(propylcarbamoylamino)benzamide hydrochloride Traditional Name: 4-chloro-N-(diaminomethylene)-3-(propylcarbamoylamino)benzamide hydrochloride Formula: C12H17Cl2N5O2 MolecularWeight: 334.20168

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC1=C(C=CC(=C1)C(=O)N=C(N)N)Cl.Cl

Isomeric SMILES

CCCNC(=O)NC1=C(C=CC(=C1)C(=O)N=C(N)N)Cl.Cl

InChI

InChI=1S/C12H16ClN5O2.ClH/c1-2-5-16-12(20)17-9-6-7(3-4-8(9)13)10(19)18-11(14)15;/h3-4,6H,2,5H2,1H3,(H2,16,17,20)(H4,14,15,18,19);1H