6-[3-piperazin-1-yl-5-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidin-3-yl]pyridine-3-carboxylic acid

Systemtic Name: 6-[3-piperazin-1-yl-5-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidin-3-yl]pyridine-3-carboxylic acid Openeye Name: 6-[3-piperazin-1-yl-5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]pyridine-3-carboxylic acid CAS Name: 6-[5-[oxo(3-thiazolidinyl)methyl]-3-(1-piperazinyl)-3-pyrrolidinyl]-3-pyridinecarboxylic acid IUPAC Name: 6-[3-piperazin-1-yl-5-(1,3-thiazolidine-3-carbonyl)pyrrolidin-3-yl]pyridine-3-carboxylic acid Traditional Name: 6-[3-piperazino-5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]nicotinic acid Formula: C18H25N5O3S MolecularWeight: 391.4878

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2(CC(NC2)C(=O)N3CCSC3)C4=NC=C(C=C4)C(=O)O

Isomeric SMILES

C1CN(CCN1)C2(CC(NC2)C(=O)N3CCSC3)C4=NC=C(C=C4)C(=O)O

InChI

InChI=1S/C18H25N5O3S/c24-16(22-7-8-27-12-22)14-9-18(11-21-14,23-5-3-19-4-6-23)15-2-1-13(10-20-15)17(25)26/h1-2,10,14,19,21H,3-9,11-12H2,(H,25,26)