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

Systemtic Name: N1,N4-bis[4-(N-butanoyl-N,N'-diethyl-carbamimidoyl)phenyl]benzene-1,4-dicarboxamide Openeye Name: N1,N4-bis[4-(N-butanoyl-N,N'-diethyl-carbamimidoyl)phenyl]terephthalamide CAS Name: N1,N4-bis[4-[ethylimino-[ethyl(1-oxobutyl)amino]methyl]phenyl]benzene-1,4-dicarboxamide IUPAC Name: 1-N,4-N-bis[4-(N-butanoyl-N,N'-diethylcarbamimidoyl)phenyl]benzene-1,4-dicarboxamide Traditional Name: N,N'-bis[4-(N-butyryl-N,N'-diethyl-amidino)phenyl]terephthalamide Formula: C38H48N6O4 MolecularWeight: 652.82552

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=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)CCC

Isomeric SMILES

CCCC(=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)CCC

InChI

InChI=1S/C38H48N6O4/c1-7-13-33(45)43(11-5)35(39-9-3)27-19-23-31(24-20-27)41-37(47)29-15-17-30(18-16-29)38(48)42-32-25-21-28(22-26-32)36(40-10-4)44(12-6)34(46)14-8-2/h15-26H,7-14H2,1-6H3,(H,41,47)(H,42,48)