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

Systemtic Name: 5-azanyl-N1,N3-bis[4-(N,N,N'-trimethylcarbamimidoyl)phenyl]benzene-1,3-dicarboxamide Openeye Name: 5-amino-N1,N3-bis[4-(N,N,N'-trimethylcarbamimidoyl)phenyl]benzene-1,3-dicarboxamide CAS Name: 5-amino-N1,N3-bis[4-[dimethylamino(methylimino)methyl]phenyl]benzene-1,3-dicarboxamide IUPAC Name: 5-amino-1-N,3-N-bis[4-(N,N,N'-trimethylcarbamimidoyl)phenyl]benzene-1,3-dicarboxamide Traditional Name: 5-amino-N,N'-bis[4-(N,N,N'-trimethylamidino)phenyl]isophthalamide Formula: C28H33N7O2 MolecularWeight: 499.60732

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(C1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)N)C(=O)NC3=CC=C(C=C3)C(=NC)N(C)C)N(C)C

Isomeric SMILES

CN=C(C1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)N)C(=O)NC3=CC=C(C=C3)C(=NC)N(C)C)N(C)C

InChI

InChI=1S/C28H33N7O2/c1-30-25(34(3)4)18-7-11-23(12-8-18)32-27(36)20-15-21(17-22(29)16-20)28(37)33-24-13-9-19(10-14-24)26(31-2)35(5)6/h7-17H,29H2,1-6H3,(H,32,36)(H,33,37)