3-(1H-indol-3-yl)-2-[2-(2-methyl-1,3-thiazol-4-yl)ethanoylamino]propanoic acid

Systemtic Name: 3-(1H-indol-3-yl)-2-[2-(2-methyl-1,3-thiazol-4-yl)ethanoylamino]propanoic acid Openeye Name: 3-(1H-indol-3-yl)-2-[[2-(2-methylthiazol-4-yl)acetyl]amino]propanoic acid CAS Name: 3-(1H-indol-3-yl)-2-[[2-(2-methyl-4-thiazolyl)-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-(1H-indol-3-yl)-2-[[2-(2-methyl-1,3-thiazol-4-yl)acetyl]amino]propanoic acid Traditional Name: 3-(1H-indol-3-yl)-2-[[2-(2-methylthiazol-4-yl)acetyl]amino]propionic acid Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC1=NC(=CS1)CC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C17H17N3O3S/c1-10-19-12(9-24-10)7-16(21)20-15(17(22)23)6-11-8-18-14-5-3-2-4-13(11)14/h2-5,8-9,15,18H,6-7H2,1H3,(H,20,21)(H,22,23)