2-[(E)-3-(phenylsulfonyl)prop-2-enyl]sulfanyl-1,3-benzothiazole

Systemtic Name: 2-[(E)-3-(phenylsulfonyl)prop-2-enyl]sulfanyl-1,3-benzothiazole Openeye Name: 2-[(E)-3-(benzenesulfonyl)allyl]sulfanyl-1,3-benzothiazole CAS Name: 2-[[(E)-3-(benzenesulfonyl)prop-2-enyl]thio]-1,3-benzothiazole IUPAC Name: 2-[(E)-3-(benzenesulfonyl)prop-2-enyl]sulfanyl-1,3-benzothiazole Traditional Name: 2-[[(E)-3-besylallyl]thio]-1,3-benzothiazole Formula: C16H13NO2S3 MolecularWeight: 347.47492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)C=CCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)/C=C/CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H13NO2S3/c18-22(19,13-7-2-1-3-8-13)12-6-11-20-16-17-14-9-4-5-10-15(14)21-16/h1-10,12H,11H2/b12-6+