3-[4-[bis(azanyl)methylideneamino]butanoylamino]-N-methyl-benzamide

Systemtic Name: 3-[4-[bis(azanyl)methylideneamino]butanoylamino]-N-methyl-benzamide Openeye Name: 3-(4-guanidinobutanoylamino)-N-methyl-benzamide CAS Name: 3-[[4-(diaminomethylideneamino)-1-oxobutyl]amino]-N-methylbenzamide IUPAC Name: 3-[4-(diaminomethylideneamino)butanoylamino]-N-methylbenzamide Traditional Name: 3-(4-guanidinobutanoylamino)-N-methyl-benzamide Formula: C13H19N5O2 MolecularWeight: 277.32226

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)NC(=O)CCCN=C(N)N

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)NC(=O)CCCN=C(N)N

InChI

InChI=1S/C13H19N5O2/c1-16-12(20)9-4-2-5-10(8-9)18-11(19)6-3-7-17-13(14)15/h2,4-5,8H,3,6-7H2,1H3,(H,16,20)(H,18,19)(H4,14,15,17)