N,N'-bis[(E)-1-[4-(thiophen-2-ylcarbonylamino)phenyl]ethylideneamino]heptanediamide

Systemtic Name: N,N'-bis[(E)-1-[4-(thiophen-2-ylcarbonylamino)phenyl]ethylideneamino]heptanediamide Openeye Name: N,N'-bis[(E)-1-[4-(thiophene-2-carbonylamino)phenyl]ethylideneamino]heptanediamide CAS Name: N,N'-bis[(E)-1-[4-[[oxo(thiophen-2-yl)methyl]amino]phenyl]ethylideneamino]heptanediamide IUPAC Name: N,N'-bis[(E)-1-[4-(thiophene-2-carbonylamino)phenyl]ethylideneamino]heptanediamide Traditional Name: N,N'-bis[(E)-1-[4-(2-thenoylamino)phenyl]ethylideneamino]pimelamide Formula: C33H34N6O4S2 MolecularWeight: 642.79086

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CCCCCC(=O)NN=C(C)C1=CC=C(C=C1)NC(=O)C2=CC=CS2)C3=CC=C(C=C3)NC(=O)C4=CC=CS4

Isomeric SMILES

C/C(=N\NC(=O)CCCCCC(=O)N/N=C(/C1=CC=C(C=C1)NC(=O)C2=CC=CS2)\C)/C3=CC=C(C=C3)NC(=O)C4=CC=CS4

InChI

InChI=1S/C33H34N6O4S2/c1-22(24-12-16-26(17-13-24)34-32(42)28-8-6-20-44-28)36-38-30(40)10-4-3-5-11-31(41)39-37-23(2)25-14-18-27(19-15-25)35-33(43)29-9-7-21-45-29/h6-9,12-21H,3-5,10-11H2,1-2H3,(H,34,42)(H,35,43)(H,38,40)(H,39,41)/b36-22+,37-23+