ethyl (2S)-4-methyl-2-[(2-pyridin-3-yl-1,3-thiazol-4-yl)carbonylamino]pentanoate

Systemtic Name: ethyl (2S)-4-methyl-2-[(2-pyridin-3-yl-1,3-thiazol-4-yl)carbonylamino]pentanoate Openeye Name: ethyl (2S)-4-methyl-2-[[2-(3-pyridyl)thiazole-4-carbonyl]amino]pentanoate CAS Name: (2S)-4-methyl-2-[[oxo-[2-(3-pyridinyl)-4-thiazolyl]methyl]amino]pentanoic acid ethyl ester IUPAC Name: ethyl (2S)-4-methyl-2-[(2-pyridin-3-yl-1,3-thiazole-4-carbonyl)amino]pentanoate Traditional Name: (2S)-4-methyl-2-[[2-(3-pyridyl)thiazole-4-carbonyl]amino]valeric acid ethyl ester Formula: C17H21N3O3S MolecularWeight: 347.43194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(C)C)NC(=O)C1=CSC(=N1)C2=CN=CC=C2

Isomeric SMILES

CCOC(=O)[C@H](CC(C)C)NC(=O)C1=CSC(=N1)C2=CN=CC=C2

InChI

InChI=1S/C17H21N3O3S/c1-4-23-17(22)13(8-11(2)3)19-15(21)14-10-24-16(20-14)12-6-5-7-18-9-12/h5-7,9-11,13H,4,8H2,1-3H3,(H,19,21)/t13-/m0/s1