N,N'-bis[4-(1,3-benzothiazol-2-yl)phenyl]hexanediamide

Systemtic Name: N,N'-bis[4-(1,3-benzothiazol-2-yl)phenyl]hexanediamide Openeye Name: N,N'-bis[4-(1,3-benzothiazol-2-yl)phenyl]hexanediamide CAS Name: N,N'-bis[4-(1,3-benzothiazol-2-yl)phenyl]hexanediamide IUPAC Name: N,N'-bis[4-(1,3-benzothiazol-2-yl)phenyl]hexanediamide Traditional Name: N,N'-bis[4-(1,3-benzothiazol-2-yl)phenyl]adipamide Formula: C32H26N4O2S2 MolecularWeight: 562.70444

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CCCCC(=O)NC4=CC=C(C=C4)C5=NC6=CC=CC=C6S5

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CCCCC(=O)NC4=CC=C(C=C4)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C32H26N4O2S2/c37-29(33-23-17-13-21(14-18-23)31-35-25-7-1-3-9-27(25)39-31)11-5-6-12-30(38)34-24-19-15-22(16-20-24)32-36-26-8-2-4-10-28(26)40-32/h1-4,7-10,13-20H,5-6,11-12H2,(H,33,37)(H,34,38)