2-[(E)-1-(1H-benzimidazol-2-yl)-2-(3-nitro-4-piperidin-1-yl-phenyl)ethenyl]-1,3-benzothiazole

Systemtic Name: 2-[(E)-1-(1H-benzimidazol-2-yl)-2-(3-nitro-4-piperidin-1-yl-phenyl)ethenyl]-1,3-benzothiazole Openeye Name: 2-[(E)-1-(1H-benzimidazol-2-yl)-2-[3-nitro-4-(1-piperidyl)phenyl]vinyl]-1,3-benzothiazole CAS Name: 2-[(E)-1-(1H-benzimidazol-2-yl)-2-[3-nitro-4-(1-piperidinyl)phenyl]ethenyl]-1,3-benzothiazole IUPAC Name: 2-[(E)-1-(1H-benzimidazol-2-yl)-2-(3-nitro-4-piperidin-1-ylphenyl)ethenyl]-1,3-benzothiazole Traditional Name: 2-[(E)-1-(1H-benzimidazol-2-yl)-2-(3-nitro-4-piperidino-phenyl)vinyl]-1,3-benzothiazole Formula: C27H23N5O2S MolecularWeight: 481.56882

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C=C(C3=NC4=CC=CC=C4N3)C5=NC6=CC=CC=C6S5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)/C=C(\C3=NC4=CC=CC=C4N3)/C5=NC6=CC=CC=C6S5)[N+](=O)[O-]

InChI

InChI=1S/C27H23N5O2S/c33-32(34)24-17-18(12-13-23(24)31-14-6-1-7-15-31)16-19(26-28-20-8-2-3-9-21(20)29-26)27-30-22-10-4-5-11-25(22)35-27/h2-5,8-13,16-17H,1,6-7,14-15H2,(H,28,29)/b19-16+