5-chloranyl-N1,N3-bis[4-(N,N'-dimethylcarbamimidoyl)phenyl]benzene-1,3-dicarboxamide

Systemtic Name: 5-chloranyl-N1,N3-bis[4-(N,N'-dimethylcarbamimidoyl)phenyl]benzene-1,3-dicarboxamide Openeye Name: 5-chloro-N1,N3-bis[4-(N,N'-dimethylcarbamimidoyl)phenyl]benzene-1,3-dicarboxamide CAS Name: 5-chloro-N1,N3-bis[4-[methylamino(methylimino)methyl]phenyl]benzene-1,3-dicarboxamide IUPAC Name: 5-chloro-1-N,3-N-bis[4-(N,N'-dimethylcarbamimidoyl)phenyl]benzene-1,3-dicarboxamide Traditional Name: 5-chloro-N,N'-bis[4-(N,N'-dimethylamidino)phenyl]isophthalamide Formula: C26H27ClN6O2 MolecularWeight: 490.98458

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=NC)C1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)Cl)C(=O)NC3=CC=C(C=C3)C(=NC)NC

Isomeric SMILES

CNC(=NC)C1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)Cl)C(=O)NC3=CC=C(C=C3)C(=NC)NC

InChI

InChI=1S/C26H27ClN6O2/c1-28-23(29-2)16-5-9-21(10-6-16)32-25(34)18-13-19(15-20(27)14-18)26(35)33-22-11-7-17(8-12-22)24(30-3)31-4/h5-15H,1-4H3,(H,28,29)(H,30,31)(H,32,34)(H,33,35)