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

Systemtic Name: N1,N4-bis[4-[N'-methyl-N-(phenylmethyl)carbamimidoyl]phenyl]benzene-1,4-dicarboxamide Openeye Name: N1,N4-bis[4-(N-benzyl-N'-methyl-carbamimidoyl)phenyl]terephthalamide CAS Name: N1,N4-bis[4-[methylimino-[(phenylmethyl)amino]methyl]phenyl]benzene-1,4-dicarboxamide IUPAC Name: 1-N,4-N-bis[4-(N-benzyl-N'-methylcarbamimidoyl)phenyl]benzene-1,4-dicarboxamide Traditional Name: N,N'-bis[4-(N-benzyl-N'-methyl-amidino)phenyl]terephthalamide Formula: C38H36N6O2 MolecularWeight: 608.73144

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=NC)NCC4=CC=CC=C4)NCC5=CC=CC=C5

Isomeric SMILES

CN=C(C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=NC)NCC4=CC=CC=C4)NCC5=CC=CC=C5

InChI

InChI=1S/C38H36N6O2/c1-39-35(41-25-27-9-5-3-6-10-27)29-17-21-33(22-18-29)43-37(45)31-13-15-32(16-14-31)38(46)44-34-23-19-30(20-24-34)36(40-2)42-26-28-11-7-4-8-12-28/h3-24H,25-26H2,1-2H3,(H,39,41)(H,40,42)(H,43,45)(H,44,46)