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

Systemtic Name: [(2R)-1-(cyclohexylamino)-1-oxidanylidene-propan-2-yl] 4-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Openeye Name: [(1R)-2-(cyclohexylamino)-1-methyl-2-oxo-ethyl] 4-[(2-methylthiazol-4-yl)methoxy]benzoate CAS Name: 4-[(2-methyl-4-thiazolyl)methoxy]benzoic acid [(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclohexylamino)-1-oxopropan-2-yl] 4-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoate Traditional Name: 4-[(2-methylthiazol-4-yl)methoxy]benzoic acid [(1R)-2-(cyclohexylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)COC2=CC=C(C=C2)C(=O)OC(C)C(=O)NC3CCCCC3

Isomeric SMILES

CC1=NC(=CS1)COC2=CC=C(C=C2)C(=O)O[C@H](C)C(=O)NC3CCCCC3

InChI

InChI=1S/C21H26N2O4S/c1-14(20(24)23-17-6-4-3-5-7-17)27-21(25)16-8-10-19(11-9-16)26-12-18-13-28-15(2)22-18/h8-11,13-14,17H,3-7,12H2,1-2H3,(H,23,24)/t14-/m1/s1