3-[[(3S)-3-[(2-ethyl-1,3-thiazol-4-yl)methyl-methyl-amino]butanoyl]amino]propanoic acid

Systemtic Name: 3-[[(3S)-3-[(2-ethyl-1,3-thiazol-4-yl)methyl-methyl-amino]butanoyl]amino]propanoic acid Openeye Name: 3-[[(3S)-3-[(2-ethylthiazol-4-yl)methyl-methyl-amino]butanoyl]amino]propanoic acid CAS Name: 3-[[(3S)-3-[(2-ethyl-4-thiazolyl)methyl-methylamino]-1-oxobutyl]amino]propanoic acid IUPAC Name: 3-[[(3S)-3-[(2-ethyl-1,3-thiazol-4-yl)methyl-methylamino]butanoyl]amino]propanoic acid Traditional Name: 3-[[(3S)-3-[(2-ethylthiazol-4-yl)methyl-methyl-amino]butanoyl]amino]propionic acid Formula: C14H23N3O3S MolecularWeight: 313.41572

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CS1)CN(C)C(C)CC(=O)NCCC(=O)O

Isomeric SMILES

CCC1=NC(=CS1)CN(C)[C@@H](C)CC(=O)NCCC(=O)O

InChI

InChI=1S/C14H23N3O3S/c1-4-13-16-11(9-21-13)8-17(3)10(2)7-12(18)15-6-5-14(19)20/h9-10H,4-8H2,1-3H3,(H,15,18)(H,19,20)/t10-/m0/s1