(2S)-4-methyl-2-[(4-methyl-2-pyrrol-1-yl-1,3-thiazol-5-yl)carbonylamino]pentanoic acid

Systemtic Name: (2S)-4-methyl-2-[(4-methyl-2-pyrrol-1-yl-1,3-thiazol-5-yl)carbonylamino]pentanoic acid Openeye Name: (2S)-4-methyl-2-[(4-methyl-2-pyrrol-1-yl-thiazole-5-carbonyl)amino]pentanoic acid CAS Name: (2S)-4-methyl-2-[[[4-methyl-2-(1-pyrrolyl)-5-thiazolyl]-oxomethyl]amino]pentanoic acid IUPAC Name: (2S)-4-methyl-2-[(4-methyl-2-pyrrol-1-yl-1,3-thiazole-5-carbonyl)amino]pentanoic acid Traditional Name: (2S)-4-methyl-2-[(4-methyl-2-pyrrol-1-yl-thiazole-5-carbonyl)amino]valeric acid Formula: C15H19N3O3S MolecularWeight: 321.39466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N2C=CC=C2)C(=O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CC1=C(SC(=N1)N2C=CC=C2)C(=O)N[C@@H](CC(C)C)C(=O)O

InChI

InChI=1S/C15H19N3O3S/c1-9(2)8-11(14(20)21)17-13(19)12-10(3)16-15(22-12)18-6-4-5-7-18/h4-7,9,11H,8H2,1-3H3,(H,17,19)(H,20,21)/t11-/m0/s1