N1,N4-bis[4-(N-but-2-enoyl-N,N'-diethyl-carbamimidoyl)phenyl]benzene-1,4-dicarboxamide

Systemtic Name: N1,N4-bis[4-(N-but-2-enoyl-N,N'-diethyl-carbamimidoyl)phenyl]benzene-1,4-dicarboxamide Openeye Name: N1,N4-bis[4-(N-but-2-enoyl-N,N'-diethyl-carbamimidoyl)phenyl]terephthalamide CAS Name: N1,N4-bis[4-[ethylimino-[ethyl(1-oxobut-2-enyl)amino]methyl]phenyl]benzene-1,4-dicarboxamide IUPAC Name: 1-N,4-N-bis[4-(N-but-2-enoyl-N,N'-diethylcarbamimidoyl)phenyl]benzene-1,4-dicarboxamide Traditional Name: N,N'-bis[4-(N-but-2-enoyl-N,N'-diethyl-amidino)phenyl]terephthalamide Formula: C38H44N6O4 MolecularWeight: 648.79376

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(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)C=CC)N(CC)C(=O)C=CC

Isomeric SMILES

CCN=C(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)C=CC)N(CC)C(=O)C=CC

InChI

InChI=1S/C38H44N6O4/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/h7-8,13-26H,9-12H2,1-6H3,(H,41,47)(H,42,48)