ethyl (E)-5-(1,3-benzothiazol-2-ylsulfanyl)pent-2-enoate

Systemtic Name: ethyl (E)-5-(1,3-benzothiazol-2-ylsulfanyl)pent-2-enoate Openeye Name: ethyl (E)-5-(1,3-benzothiazol-2-ylsulfanyl)pent-2-enoate CAS Name: (E)-5-(1,3-benzothiazol-2-ylthio)-2-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-5-(1,3-benzothiazol-2-ylsulfanyl)pent-2-enoate Traditional Name: (E)-5-(1,3-benzothiazol-2-ylthio)pent-2-enoic acid ethyl ester Formula: C14H15NO2S2 MolecularWeight: 293.4044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCCSC1=NC2=CC=CC=C2S1

Isomeric SMILES

CCOC(=O)/C=C/CCSC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C14H15NO2S2/c1-2-17-13(16)9-5-6-10-18-14-15-11-7-3-4-8-12(11)19-14/h3-5,7-9H,2,6,10H2,1H3/b9-5+