2-[3-[(2-pyridin-3-yl-1,2-thiazolidin-4-yl)carbonyl]-1H-indol-2-yl]propanoic acid

Systemtic Name: 2-[3-[(2-pyridin-3-yl-1,2-thiazolidin-4-yl)carbonyl]-1H-indol-2-yl]propanoic acid Openeye Name: 2-[3-[2-(3-pyridyl)isothiazolidine-4-carbonyl]-1H-indol-2-yl]propanoic acid CAS Name: 2-[3-[oxo-[2-(3-pyridinyl)-4-isothiazolidinyl]methyl]-1H-indol-2-yl]propanoic acid IUPAC Name: 2-[3-(2-pyridin-3-yl-1,2-thiazolidine-4-carbonyl)-1H-indol-2-yl]propanoic acid Traditional Name: 2-[3-[2-(3-pyridyl)isothiazolidine-4-carbonyl]-1H-indol-2-yl]propionic acid Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C2=CC=CC=C2N1)C(=O)C3CN(SC3)C4=CN=CC=C4)C(=O)O

Isomeric SMILES

CC(C1=C(C2=CC=CC=C2N1)C(=O)C3CN(SC3)C4=CN=CC=C4)C(=O)O

InChI

InChI=1S/C20H19N3O3S/c1-12(20(25)26)18-17(15-6-2-3-7-16(15)22-18)19(24)13-10-23(27-11-13)14-5-4-8-21-9-14/h2-9,12-13,22H,10-11H2,1H3,(H,25,26)