(2,5-dimethyl-1H-indol-3-yl)-(2-pyridin-3-yl-1,2-thiazolidin-4-yl)methanone; ethanedioic acid

Systemtic Name: (2,5-dimethyl-1H-indol-3-yl)-(2-pyridin-3-yl-1,2-thiazolidin-4-yl)methanone; ethanedioic acid Openeye Name: (2,5-dimethyl-1H-indol-3-yl)-[2-(3-pyridyl)isothiazolidin-4-yl]methanone; oxalic acid CAS Name: (2,5-dimethyl-1H-indol-3-yl)-[2-(3-pyridinyl)-4-isothiazolidinyl]methanone; oxalic acid IUPAC Name: (2,5-dimethyl-1H-indol-3-yl)-(2-pyridin-3-yl-1,2-thiazolidin-4-yl)methanone; oxalic acid Traditional Name: (2,5-dimethyl-1H-indol-3-yl)-[2-(3-pyridyl)isothiazolidin-4-yl]methanone; oxalic acid Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2C(=O)C3CN(SC3)C4=CN=CC=C4)C.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2C(=O)C3CN(SC3)C4=CN=CC=C4)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H19N3OS.C2H2O4/c1-12-5-6-17-16(8-12)18(13(2)21-17)19(23)14-10-22(24-11-14)15-4-3-7-20-9-15;3-1(4)2(5)6/h3-9,14,21H,10-11H2,1-2H3;(H,3,4)(H,5,6)