2-[2-chloranyl-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbonyl-phenyl]-1,1-bis(oxidanylidene)-1,2-thiazolidin-3-one

Systemtic Name: 2-[2-chloranyl-5-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbonyl-phenyl]-1,1-bis(oxidanylidene)-1,2-thiazolidin-3-one Openeye Name: 2-[2-chloro-5-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)phenyl]-1,1-dioxo-1,2-thiazolidin-3-one CAS Name: 2-[2-chloro-5-[oxo-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]phenyl]-1,1-dioxo-1,2-thiazolidin-3-one IUPAC Name: 2-[2-chloro-5-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)phenyl]-1,1-dioxo-1,2-thiazolidin-3-one Traditional Name: 2-[2-chloro-5-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)phenyl]-1,1-diketo-1,2-thiazolidin-3-one Formula: C19H20ClN4O4S+ MolecularWeight: 435.9045

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)N(C1=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4)Cl

Isomeric SMILES

C1CS(=O)(=O)N(C1=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)C4=CC=CC=[NH+]4)Cl

InChI

InChI=1S/C19H19ClN4O4S/c20-15-5-4-14(13-16(15)24-18(25)6-12-29(24,27)28)19(26)23-10-8-22(9-11-23)17-3-1-2-7-21-17/h1-5,7,13H,6,8-12H2/p+1