(2S)-4-methyl-2-[(5-methylthiophen-2-yl)carbonylamino]pentanoic acid

Systemtic Name: (2S)-4-methyl-2-[(5-methylthiophen-2-yl)carbonylamino]pentanoic acid Openeye Name: (2S)-4-methyl-2-[(5-methylthiophene-2-carbonyl)amino]pentanoic acid CAS Name: (2S)-4-methyl-2-[[(5-methyl-2-thiophenyl)-oxomethyl]amino]pentanoic acid IUPAC Name: (2S)-4-methyl-2-[(5-methylthiophene-2-carbonyl)amino]pentanoic acid Traditional Name: (2S)-4-methyl-2-[(5-methylthiophene-2-carbonyl)amino]valeric acid Formula: C12H17NO3S MolecularWeight: 255.33328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)NC(CC(C)C)C(=O)O

Isomeric SMILES

CC1=CC=C(S1)C(=O)N[C@@H](CC(C)C)C(=O)O

InChI

InChI=1S/C12H17NO3S/c1-7(2)6-9(12(15)16)13-11(14)10-5-4-8(3)17-10/h4-5,7,9H,6H2,1-3H3,(H,13,14)(H,15,16)/t9-/m0/s1