ethyl 2-[[3-ethoxypropyl-[(2R)-2-phenylbutanoyl]amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[3-ethoxypropyl-[(2R)-2-phenylbutanoyl]amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[3-ethoxypropyl-[(2R)-2-phenylbutanoyl]amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[3-ethoxypropyl-[(2R)-1-oxo-2-phenylbutyl]amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-ethoxypropyl-[(2R)-2-phenylbutanoyl]amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[3-ethoxypropyl-[(2R)-2-phenylbutanoyl]amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N(CCCOCC)CC2=NC(=CS2)C(=O)OCC

Isomeric SMILES

CC[C@H](C1=CC=CC=C1)C(=O)N(CCCOCC)CC2=NC(=CS2)C(=O)OCC

InChI

InChI=1S/C22H30N2O4S/c1-4-18(17-11-8-7-9-12-17)21(25)24(13-10-14-27-5-2)15-20-23-19(16-29-20)22(26)28-6-3/h7-9,11-12,16,18H,4-6,10,13-15H2,1-3H3/t18-/m1/s1