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3-(1,3-benzothiazol-2-ylsulfanyl)-2-cyclohexyl-propanoate

3-(1,3-benzothiazol-2-ylsulfanyl)-2-cyclohexyl-propanoate

Systemtic Name:3-(1,3-benzothiazol-2-ylsulfanyl)-2-cyclohexyl-propanoate
Openeye Name:3-(1,3-benzothiazol-2-ylsulfanyl)-2-cyclohexyl-propanoate
CAS Name:3-(1,3-benzothiazol-2-ylthio)-2-cyclohexylpropanoate
IUPAC Name:3-(1,3-benzothiazol-2-ylsulfanyl)-2-cyclohexylpropanoate
Traditional Name:3-(1,3-benzothiazol-2-ylthio)-2-cyclohexyl-propionate
Formula: C16H18NO2S2-
MolecularWeight: 320.44962
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(CSC2=NC3=CC=CC=C3S2)C(=O)[O-]


Isomeric SMILES

C1CCC(CC1)C(CSC2=NC3=CC=CC=C3S2)C(=O)[O-]


InChI

InChI=1S/C16H19NO2S2/c18-15(19)12(11-6-2-1-3-7-11)10-20-16-17-13-8-4-5-9-14(13)21-16/h4-5,8-9,11-12H,1-3,6-7,10H2,(H,18,19)/p-1


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