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

Systemtic Name: methyl 2-[3-[(2-pyridin-3-yl-1,2-thiazolidin-4-yl)carbonyl]-1H-indol-2-yl]propanoate Openeye Name: methyl 2-[3-[2-(3-pyridyl)isothiazolidine-4-carbonyl]-1H-indol-2-yl]propanoate CAS Name: 2-[3-[oxo-[2-(3-pyridinyl)-4-isothiazolidinyl]methyl]-1H-indol-2-yl]propanoic acid methyl ester IUPAC Name: methyl 2-[3-(2-pyridin-3-yl-1,2-thiazolidine-4-carbonyl)-1H-indol-2-yl]propanoate Traditional Name: 2-[3-[2-(3-pyridyl)isothiazolidine-4-carbonyl]-1H-indol-2-yl]propionic acid methyl ester Formula: C21H21N3O3S MolecularWeight: 395.47474

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H21N3O3S/c1-13(21(26)27-2)19-18(16-7-3-4-8-17(16)23-19)20(25)14-11-24(28-12-14)15-6-5-9-22-10-15/h3-10,13-14,23H,11-12H2,1-2H3