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

Systemtic Name: 2-chloranyl-N1,N4-bis[4-(N'-propylcarbamimidoyl)phenyl]benzene-1,4-dicarboxamide Openeye Name: 2-chloro-N1,N4-bis[4-(N'-propylcarbamimidoyl)phenyl]terephthalamide CAS Name: N1,N4-bis[4-[amino(propylimino)methyl]phenyl]-2-chlorobenzene-1,4-dicarboxamide IUPAC Name: 2-chloro-1-N,4-N-bis[4-(N'-propylcarbamimidoyl)phenyl]benzene-1,4-dicarboxamide Traditional Name: 2-chloro-N,N'-bis[4-(N'-propylamidino)phenyl]terephthalamide Formula: C28H31ClN6O2 MolecularWeight: 519.03774

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Descriptors Computed from Structure

Canonical SMILES:

CCCN=C(C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=NCCC)N)Cl)N

Isomeric SMILES

CCCN=C(C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=NCCC)N)Cl)N

InChI

InChI=1S/C28H31ClN6O2/c1-3-15-32-25(30)18-5-10-21(11-6-18)34-27(36)20-9-14-23(24(29)17-20)28(37)35-22-12-7-19(8-13-22)26(31)33-16-4-2/h5-14,17H,3-4,15-16H2,1-2H3,(H2,30,32)(H2,31,33)(H,34,36)(H,35,37)