N1,N4-bis[4-(N,N'-diethyl-N-propanoyl-carbamimidoyl)phenyl]benzene-1,4-dicarboxamide

Systemtic Name: N1,N4-bis[4-(N,N'-diethyl-N-propanoyl-carbamimidoyl)phenyl]benzene-1,4-dicarboxamide Openeye Name: N1,N4-bis[4-(N,N'-diethyl-N-propanoyl-carbamimidoyl)phenyl]terephthalamide CAS Name: N1,N4-bis[4-[ethylimino-[ethyl(1-oxopropyl)amino]methyl]phenyl]benzene-1,4-dicarboxamide IUPAC Name: 1-N,4-N-bis[4-(N,N'-diethyl-N-propanoylcarbamimidoyl)phenyl]benzene-1,4-dicarboxamide Traditional Name: N,N'-bis[4-(N,N'-diethyl-N-propionyl-amidino)phenyl]terephthalamide Formula: C36H44N6O4 MolecularWeight: 624.77236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C36H44N6O4/c1-7-31(43)41(11-5)33(37-9-3)25-17-21-29(22-18-25)39-35(45)27-13-15-28(16-14-27)36(46)40-30-23-19-26(20-24-30)34(38-10-4)42(12-6)32(44)8-2/h13-24H,7-12H2,1-6H3,(H,39,45)(H,40,46)