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

Systemtic Name: ethyl 6-[3-piperazin-1-yl-5-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidin-3-yl]pyridine-3-carboxylate Openeye Name: ethyl 6-[3-piperazin-1-yl-5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]pyridine-3-carboxylate CAS Name: 6-[5-[oxo(3-thiazolidinyl)methyl]-3-(1-piperazinyl)-3-pyrrolidinyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[3-piperazin-1-yl-5-(1,3-thiazolidine-3-carbonyl)pyrrolidin-3-yl]pyridine-3-carboxylate Traditional Name: 6-[3-piperazino-5-(thiazolidine-3-carbonyl)pyrrolidin-3-yl]nicotinic acid ethyl ester Formula: C20H29N5O3S MolecularWeight: 419.54096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)C2(CC(NC2)C(=O)N3CCSC3)N4CCNCC4

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)C2(CC(NC2)C(=O)N3CCSC3)N4CCNCC4

InChI

InChI=1S/C20H29N5O3S/c1-2-28-19(27)15-3-4-17(22-12-15)20(25-7-5-21-6-8-25)11-16(23-13-20)18(26)24-9-10-29-14-24/h3-4,12,16,21,23H,2,5-11,13-14H2,1H3