(4Z)-4-(bromanylmethylidene)-N-carbamimidoyl-N-piperazin-1-yl-cyclohexa-1,5-diene-1-carboxamide

Systemtic Name: (4Z)-4-(bromanylmethylidene)-N-carbamimidoyl-N-piperazin-1-yl-cyclohexa-1,5-diene-1-carboxamide Openeye Name: (4Z)-4-(bromomethylene)-N-carbamimidoyl-N-piperazin-1-yl-cyclohexa-1,5-diene-1-carboxamide CAS Name: (4Z)-4-(bromomethylidene)-N-carbamimidoyl-N-(1-piperazinyl)-1-cyclohexa-1,5-dienecarboxamide IUPAC Name: (4Z)-4-(bromomethylidene)-N-carbamimidoyl-N-piperazin-1-ylcyclohexa-1,5-diene-1-carboxamide Traditional Name: (4Z)-N-amidino-4-(bromomethylene)-N-piperazino-cyclohexa-1,5-diene-1-carboxamide Formula: C13H18BrN5O MolecularWeight: 340.21892

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)N(C(=O)C2=CCC(=CBr)C=C2)C(=N)N

Isomeric SMILES

C1CN(CCN1)N(C(=O)C2=CC/C(=C/Br)/C=C2)C(=N)N

InChI

InChI=1S/C13H18BrN5O/c14-9-10-1-3-11(4-2-10)12(20)19(13(15)16)18-7-5-17-6-8-18/h1,3-4,9,17H,2,5-8H2,(H3,15,16)/b10-9+