2-[(2E)-3-methylpenta-2,4-dienyl]sulfonyl-1,3-benzothiazole

Systemtic Name: 2-[(2E)-3-methylpenta-2,4-dienyl]sulfonyl-1,3-benzothiazole Openeye Name: 2-[(2E)-3-methylpenta-2,4-dienyl]sulfonyl-1,3-benzothiazole CAS Name: 2-[(2E)-3-methylpenta-2,4-dienyl]sulfonyl-1,3-benzothiazole IUPAC Name: 2-[(2E)-3-methylpenta-2,4-dienyl]sulfonyl-1,3-benzothiazole Traditional Name: 2-[(2E)-3-methylpenta-2,4-dienyl]sulfonyl-1,3-benzothiazole Formula: C13H13NO2S2 MolecularWeight: 279.37782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCS(=O)(=O)C1=NC2=CC=CC=C2S1)C=C

Isomeric SMILES

C/C(=C\CS(=O)(=O)C1=NC2=CC=CC=C2S1)/C=C

InChI

InChI=1S/C13H13NO2S2/c1-3-10(2)8-9-18(15,16)13-14-11-6-4-5-7-12(11)17-13/h3-8H,1,9H2,2H3/b10-8+