2-azanyl-3-[2-[(2-methyl-1-thiophen-2-yl-propyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanoic acid

Systemtic Name: 2-azanyl-3-[2-[(2-methyl-1-thiophen-2-yl-propyl)amino]-2-oxidanylidene-ethyl]sulfanyl-propanoic acid Openeye Name: 2-amino-3-[2-[[2-methyl-1-(2-thienyl)propyl]amino]-2-oxo-ethyl]sulfanyl-propanoic acid CAS Name: 2-amino-3-[[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]thio]propanoic acid IUPAC Name: 2-amino-3-[2-[(2-methyl-1-thiophen-2-ylpropyl)amino]-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 2-amino-3-[[2-keto-2-[[2-methyl-1-(2-thienyl)propyl]amino]ethyl]thio]propionic acid Formula: C13H20N2O3S2 MolecularWeight: 316.4395

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)NC(=O)CSCC(C(=O)O)N

Isomeric SMILES

CC(C)C(C1=CC=CS1)NC(=O)CSCC(C(=O)O)N

InChI

InChI=1S/C13H20N2O3S2/c1-8(2)12(10-4-3-5-20-10)15-11(16)7-19-6-9(14)13(17)18/h3-5,8-9,12H,6-7,14H2,1-2H3,(H,15,16)(H,17,18)