[2-[cyclohexyl(methyl)amino]-2-oxidanylidene-ethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate

Systemtic Name: [2-[cyclohexyl(methyl)amino]-2-oxidanylidene-ethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate Openeye Name: [2-[cyclohexyl(methyl)amino]-2-oxo-ethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid [2-[cyclohexyl(methyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[cyclohexyl(methyl)amino]-2-oxoethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid [2-[cyclohexyl(methyl)amino]-2-keto-ethyl] ester Formula: C18H22N2O3S2 MolecularWeight: 378.50888

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=O)COC(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CN(C1CCCCC1)C(=O)COC(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H22N2O3S2/c1-20(13-7-3-2-4-8-13)16(21)11-23-17(22)12-24-18-19-14-9-5-6-10-15(14)25-18/h5-6,9-10,13H,2-4,7-8,11-12H2,1H3