ethyl 2-[[1-ethoxy-1-oxidanylidene-3-(2-phenyl-1,3-thiazol-4-yl)propan-2-yl]amino]-4-methyl-pentanoate

Systemtic Name: ethyl 2-[[1-ethoxy-1-oxidanylidene-3-(2-phenyl-1,3-thiazol-4-yl)propan-2-yl]amino]-4-methyl-pentanoate Openeye Name: ethyl 2-[[2-ethoxy-2-oxo-1-[(2-phenylthiazol-4-yl)methyl]ethyl]amino]-4-methyl-pentanoate CAS Name: 2-[[1-ethoxy-1-oxo-3-(2-phenyl-4-thiazolyl)propan-2-yl]amino]-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl 2-[[1-ethoxy-1-oxo-3-(2-phenyl-1,3-thiazol-4-yl)propan-2-yl]amino]-4-methylpentanoate Traditional Name: 2-[[2-ethoxy-2-keto-1-[(2-phenylthiazol-4-yl)methyl]ethyl]amino]-4-methyl-valeric acid ethyl ester Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CSC(=N1)C2=CC=CC=C2)NC(CC(C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC1=CSC(=N1)C2=CC=CC=C2)NC(CC(C)C)C(=O)OCC

InChI

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