(4-piperazin-1-yl-4-quinolin-8-ylsulfonyl-pyrrolidin-2-yl)-(1,3-thiazolidin-3-yl)methanone trihydrochloride

Systemtic Name: (4-piperazin-1-yl-4-quinolin-8-ylsulfonyl-pyrrolidin-2-yl)-(1,3-thiazolidin-3-yl)methanone trihydrochloride Openeye Name: [4-piperazin-1-yl-4-(8-quinolylsulfonyl)pyrrolidin-2-yl]-thiazolidin-3-yl-methanone trihydrochloride CAS Name: [4-(1-piperazinyl)-4-(8-quinolinylsulfonyl)-2-pyrrolidinyl]-(3-thiazolidinyl)methanone trihydrochloride IUPAC Name: (4-piperazin-1-yl-4-quinolin-8-ylsulfonylpyrrolidin-2-yl)-(1,3-thiazolidin-3-yl)methanone trihydrochloride Traditional Name: [4-piperazino-4-(8-quinolylsulfonyl)pyrrolidin-2-yl]-thiazolidin-3-yl-methanone trihydrochloride Formula: C21H30Cl3N5O3S2 MolecularWeight: 570.9836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2(CC(NC2)C(=O)N3CCSC3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5.Cl.Cl.Cl

Isomeric SMILES

C1CN(CCN1)C2(CC(NC2)C(=O)N3CCSC3)S(=O)(=O)C4=CC=CC5=C4N=CC=C5.Cl.Cl.Cl

InChI

InChI=1S/C21H27N5O3S2.3ClH/c27-20(25-11-12-30-15-25)17-13-21(14-24-17,26-9-7-22-8-10-26)31(28,29)18-5-1-3-16-4-2-6-23-19(16)18;;;/h1-6,17,22,24H,7-15H2;3*1H