[(2R)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl] 5-(1,3-benzothiazol-2-yl)pentanoate

Systemtic Name: [(2R)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl] 5-(1,3-benzothiazol-2-yl)pentanoate Openeye Name: [(1R)-2-(2-methoxyethylamino)-1-methyl-2-oxo-ethyl] 5-(1,3-benzothiazol-2-yl)pentanoate CAS Name: 5-(1,3-benzothiazol-2-yl)pentanoic acid [(2R)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-methoxyethylamino)-1-oxopropan-2-yl] 5-(1,3-benzothiazol-2-yl)pentanoate Traditional Name: 5-(1,3-benzothiazol-2-yl)valeric acid [(1R)-2-keto-2-(2-methoxyethylamino)-1-methyl-ethyl] ester Formula: C18H24N2O4S MolecularWeight: 364.45916

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCOC)OC(=O)CCCCC1=NC2=CC=CC=C2S1

Isomeric SMILES

C[C@H](C(=O)NCCOC)OC(=O)CCCCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C18H24N2O4S/c1-13(18(22)19-11-12-23-2)24-17(21)10-6-5-9-16-20-14-7-3-4-8-15(14)25-16/h3-4,7-8,13H,5-6,9-12H2,1-2H3,(H,19,22)/t13-/m1/s1