2-chloranyl-N1,N4-bis[4-(N,N'-dimethylcarbamimidoyl)phenyl]benzene-1,4-dicarboxamide

Systemtic Name: 2-chloranyl-N1,N4-bis[4-(N,N'-dimethylcarbamimidoyl)phenyl]benzene-1,4-dicarboxamide Openeye Name: 2-chloro-N1,N4-bis[4-(N,N'-dimethylcarbamimidoyl)phenyl]terephthalamide CAS Name: 2-chloro-N1,N4-bis[4-[methylamino(methylimino)methyl]phenyl]benzene-1,4-dicarboxamide IUPAC Name: 2-chloro-1-N,4-N-bis[4-(N,N'-dimethylcarbamimidoyl)phenyl]benzene-1,4-dicarboxamide Traditional Name: 2-chloro-N,N'-bis[4-(N,N'-dimethylamidino)phenyl]terephthalamide 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(=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=NC)NC)Cl

Isomeric SMILES

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

InChI

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