(2S)-3-methyl-2-[methylsulfonyl(thiophen-2-ylmethyl)amino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[methylsulfonyl(thiophen-2-ylmethyl)amino]butanoic acid Openeye Name: (2S)-3-methyl-2-[methylsulfonyl(2-thienylmethyl)amino]butanoic acid CAS Name: (2S)-3-methyl-2-[methylsulfonyl(thiophen-2-ylmethyl)amino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[methylsulfonyl(thiophen-2-ylmethyl)amino]butanoic acid Traditional Name: (2S)-2-[mesyl(2-thenyl)amino]-3-methyl-butyric acid Formula: C11H17NO4S2 MolecularWeight: 291.38698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N(CC1=CC=CS1)S(=O)(=O)C

Isomeric SMILES

CC(C)[C@@H](C(=O)O)N(CC1=CC=CS1)S(=O)(=O)C

InChI

InChI=1S/C11H17NO4S2/c1-8(2)10(11(13)14)12(18(3,15)16)7-9-5-4-6-17-9/h4-6,8,10H,7H2,1-3H3,(H,13,14)/t10-/m0/s1