2-[2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]ethenyl]-5-nitro-1,3-benzothiazole

Systemtic Name: 2-[2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]ethenyl]-5-nitro-1,3-benzothiazole Openeye Name: 2-[2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]vinyl]-5-nitro-1,3-benzothiazole CAS Name: 2-[2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolyl]ethenyl]-5-nitro-1,3-benzothiazole IUPAC Name: 2-[2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazol-4-yl]ethenyl]-5-nitro-1,3-benzothiazole Traditional Name: 2-[2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]vinyl]-5-nitro-1,3-benzothiazole Formula: C26H18N4O4S MolecularWeight: 482.51052

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=NN(C=C3C=CC4=NC5=C(S4)C=CC(=C5)[N+](=O)[O-])C6=CC=CC=C6

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=NN(C=C3C=CC4=NC5=C(S4)C=CC(=C5)[N+](=O)[O-])C6=CC=CC=C6

InChI

InChI=1S/C26H18N4O4S/c31-30(32)20-8-10-24-21(15-20)27-25(35-24)11-7-18-16-29(19-4-2-1-3-5-19)28-26(18)17-6-9-22-23(14-17)34-13-12-33-22/h1-11,14-16H,12-13H2