methyl (2S)-3-methyl-2-[(5-methylthiophen-2-yl)methylamino]butanoate

Systemtic Name: methyl (2S)-3-methyl-2-[(5-methylthiophen-2-yl)methylamino]butanoate Openeye Name: methyl (2S)-3-methyl-2-[(5-methyl-2-thienyl)methylamino]butanoate CAS Name: (2S)-3-methyl-2-[(5-methyl-2-thiophenyl)methylamino]butanoic acid methyl ester IUPAC Name: methyl (2S)-3-methyl-2-[(5-methylthiophen-2-yl)methylamino]butanoate Traditional Name: (2S)-3-methyl-2-[(5-methyl-2-thienyl)methylamino]butyric acid methyl ester Formula: C12H19NO2S MolecularWeight: 241.34976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CNC(C(C)C)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO2S/c1-8(2)11(12(14)15-4)13-7-10-6-5-9(3)16-10/h5-6,8,11,13H,7H2,1-4H3/t11-/m0/s1