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

Systemtic Name: N1,N3-bis[4-(N,N'-dimethylcarbamimidoyl)phenyl]-5-methyl-benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis[4-(N,N'-dimethylcarbamimidoyl)phenyl]-5-methyl-benzene-1,3-dicarboxamide CAS Name: 5-methyl-N1,N3-bis[4-[methylamino(methylimino)methyl]phenyl]benzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis[4-(N,N'-dimethylcarbamimidoyl)phenyl]-5-methylbenzene-1,3-dicarboxamide Traditional Name: N,N'-bis[4-(N,N'-dimethylamidino)phenyl]-5-methyl-isophthalamide Formula: C27H30N6O2 MolecularWeight: 470.5661

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=NC)NC)C(=O)NC3=CC=C(C=C3)C(=NC)NC

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NC2=CC=C(C=C2)C(=NC)NC)C(=O)NC3=CC=C(C=C3)C(=NC)NC

InChI

InChI=1S/C27H30N6O2/c1-17-14-20(26(34)32-22-10-6-18(7-11-22)24(28-2)29-3)16-21(15-17)27(35)33-23-12-8-19(9-13-23)25(30-4)31-5/h6-16H,1-5H3,(H,28,29)(H,30,31)(H,32,34)(H,33,35)