2-[(E)-2-(1,3-benzodioxol-5-yl)-1-phenoxy-ethenyl]-1,3-benzothiazole

Systemtic Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)-1-phenoxy-ethenyl]-1,3-benzothiazole Openeye Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)-1-phenoxy-vinyl]-1,3-benzothiazole CAS Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)-1-phenoxyethenyl]-1,3-benzothiazole IUPAC Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)-1-phenoxyethenyl]-1,3-benzothiazole Traditional Name: 2-[(E)-2-(1,3-benzodioxol-5-yl)-1-phenoxy-vinyl]-1,3-benzothiazole Formula: C22H15NO3S MolecularWeight: 373.4244

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C3=NC4=CC=CC=C4S3)OC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(\C3=NC4=CC=CC=C4S3)/OC5=CC=CC=C5

InChI

InChI=1S/C22H15NO3S/c1-2-6-16(7-3-1)26-20(22-23-17-8-4-5-9-21(17)27-22)13-15-10-11-18-19(12-15)25-14-24-18/h1-13H,14H2/b20-13+