methyl (2S,3S)-3-methyl-2-(thiophen-2-ylmethylcarbamoylamino)pentanoate

Systemtic Name: methyl (2S,3S)-3-methyl-2-(thiophen-2-ylmethylcarbamoylamino)pentanoate Openeye Name: methyl (2S,3S)-3-methyl-2-(2-thienylmethylcarbamoylamino)pentanoate CAS Name: (2S,3S)-3-methyl-2-[[oxo-(thiophen-2-ylmethylamino)methyl]amino]pentanoic acid methyl ester IUPAC Name: methyl (2S,3S)-3-methyl-2-(thiophen-2-ylmethylcarbamoylamino)pentanoate Traditional Name: (2S,3S)-3-methyl-2-(2-thenylcarbamoylamino)valeric acid methyl ester Formula: C13H20N2O3S MolecularWeight: 284.3745

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)NCC1=CC=CS1

Isomeric SMILES

CC[C@H](C)[C@@H](C(=O)OC)NC(=O)NCC1=CC=CS1

InChI

InChI=1S/C13H20N2O3S/c1-4-9(2)11(12(16)18-3)15-13(17)14-8-10-6-5-7-19-10/h5-7,9,11H,4,8H2,1-3H3,(H2,14,15,17)/t9-,11-/m0/s1