[(2S)-1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate

Systemtic Name: [(2S)-1-(cycloheptylamino)-1-oxidanylidene-propan-2-yl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Openeye Name: [(1S)-2-(cycloheptylamino)-1-methyl-2-oxo-ethyl] 2-[(2-methylthiazol-4-yl)methoxy]benzoate CAS Name: 2-[(2-methyl-4-thiazolyl)methoxy]benzoic acid [(2S)-1-(cycloheptylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(cycloheptylamino)-1-oxopropan-2-yl] 2-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Traditional Name: 2-[(2-methylthiazol-4-yl)methoxy]benzoic acid [(1S)-2-(cycloheptylamino)-2-keto-1-methyl-ethyl] ester Formula: C22H28N2O4S MolecularWeight: 416.53372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)COC2=CC=CC=C2C(=O)OC(C)C(=O)NC3CCCCCC3

Isomeric SMILES

CC1=NC(=CS1)COC2=CC=CC=C2C(=O)O[C@@H](C)C(=O)NC3CCCCCC3

InChI

InChI=1S/C22H28N2O4S/c1-15(21(25)24-17-9-5-3-4-6-10-17)28-22(26)19-11-7-8-12-20(19)27-13-18-14-29-16(2)23-18/h7-8,11-12,14-15,17H,3-6,9-10,13H2,1-2H3,(H,24,25)/t15-/m0/s1