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

Systemtic Name: (E)-N,N'-bis[4-(1,3-benzothiazol-2-yl)phenyl]but-2-enediamide Openeye Name: (E)-N,N'-bis[4-(1,3-benzothiazol-2-yl)phenyl]but-2-enediamide CAS Name: (E)-N,N'-bis[4-(1,3-benzothiazol-2-yl)phenyl]-2-butenediamide IUPAC Name: (E)-N,N'-bis[4-(1,3-benzothiazol-2-yl)phenyl]but-2-enediamide Traditional Name: (E)-N,N'-bis[4-(1,3-benzothiazol-2-yl)phenyl]but-2-enediamide Formula: C30H20N4O2S2 MolecularWeight: 532.6354

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C30H20N4O2S2/c35-27(31-21-13-9-19(10-14-21)29-33-23-5-1-3-7-25(23)37-29)17-18-28(36)32-22-15-11-20(12-16-22)30-34-24-6-2-4-8-26(24)38-30/h1-18H,(H,31,35)(H,32,36)/b18-17+