2-[(E)-3-(4-methylphenyl)sulfonylprop-2-enyl]sulfanyl-1,3-benzothiazole

Systemtic Name: 2-[(E)-3-(4-methylphenyl)sulfonylprop-2-enyl]sulfanyl-1,3-benzothiazole Openeye Name: 2-[(E)-3-(p-tolylsulfonyl)allyl]sulfanyl-1,3-benzothiazole CAS Name: 2-[[(E)-3-(4-methylphenyl)sulfonylprop-2-enyl]thio]-1,3-benzothiazole IUPAC Name: 2-[(E)-3-(4-methylphenyl)sulfonylprop-2-enyl]sulfanyl-1,3-benzothiazole Traditional Name: 2-[[(E)-3-tosylallyl]thio]-1,3-benzothiazole Formula: C17H15NO2S3 MolecularWeight: 361.5015

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C=CCSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C=C/CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H15NO2S3/c1-13-7-9-14(10-8-13)23(19,20)12-4-11-21-17-18-15-5-2-3-6-16(15)22-17/h2-10,12H,11H2,1H3/b12-4+