[(1S)-2-oxidanylidenecyclohexyl] 2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate Openeye Name: [(1S)-2-oxocyclohexyl] 2-[(4-methylthiazol-2-yl)sulfanylmethyl]benzoate CAS Name: 2-[[(4-methyl-2-thiazolyl)thio]methyl]benzoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 2-[(4-methyl-1,3-thiazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 2-[[(4-methylthiazol-2-yl)thio]methyl]benzoic acid [(1S)-2-ketocyclohexyl] ester Formula: C18H19NO3S2 MolecularWeight: 361.47836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SCC2=CC=CC=C2C(=O)OC3CCCCC3=O

Isomeric SMILES

CC1=CSC(=N1)SCC2=CC=CC=C2C(=O)O[C@H]3CCCCC3=O

InChI

InChI=1S/C18H19NO3S2/c1-12-10-23-18(19-12)24-11-13-6-2-3-7-14(13)17(21)22-16-9-5-4-8-15(16)20/h2-3,6-7,10,16H,4-5,8-9,11H2,1H3/t16-/m0/s1