5-chloranyl-6-[4-[5-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidin-3-yl]piperazin-1-yl]pyridine-3-carboxylic acid

Systemtic Name: 5-chloranyl-6-[4-[5-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidin-3-yl]piperazin-1-yl]pyridine-3-carboxylic acid Openeye Name: 5-chloro-6-[4-[5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]piperazin-1-yl]pyridine-3-carboxylic acid CAS Name: 5-chloro-6-[4-[5-[oxo(3-thiazolidinyl)methyl]-3-pyrrolidinyl]-1-piperazinyl]-3-pyridinecarboxylic acid IUPAC Name: 5-chloro-6-[4-[5-(1,3-thiazolidine-3-carbonyl)pyrrolidin-3-yl]piperazin-1-yl]pyridine-3-carboxylic acid Traditional Name: 5-chloro-6-[4-[5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]piperazino]nicotinic acid Formula: C18H24ClN5O3S MolecularWeight: 425.93286

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2CC(NC2)C(=O)N3CCSC3)C4=C(C=C(C=N4)C(=O)O)Cl

Isomeric SMILES

C1CN(CCN1C2CC(NC2)C(=O)N3CCSC3)C4=C(C=C(C=N4)C(=O)O)Cl

InChI

InChI=1S/C18H24ClN5O3S/c19-14-7-12(18(26)27)9-21-16(14)23-3-1-22(2-4-23)13-8-15(20-10-13)17(25)24-5-6-28-11-24/h7,9,13,15,20H,1-6,8,10-11H2,(H,26,27)