6-[2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-N,N-diethyl-pyridine-3-sulfonamide

Systemtic Name: 6-[2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-N,N-diethyl-pyridine-3-sulfonamide Openeye Name: 6-[2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-2-oxo-ethyl]sulfanyl-N,N-diethyl-pyridine-3-sulfonamide CAS Name: 6-[[2-[4-[(3-chlorophenyl)methyl]-1-piperazinyl]-2-oxoethyl]thio]-N,N-diethyl-3-pyridinesulfonamide IUPAC Name: 6-[2-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-2-oxoethyl]sulfanyl-N,N-diethylpyridine-3-sulfonamide Traditional Name: 6-[[2-[4-(3-chlorobenzyl)piperazino]-2-keto-ethyl]thio]-N,N-diethyl-pyridine-3-sulfonamide Formula: C22H29ClN4O3S2 MolecularWeight: 497.07366

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CN=C(C=C1)SCC(=O)N2CCN(CC2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CN=C(C=C1)SCC(=O)N2CCN(CC2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C22H29ClN4O3S2/c1-3-27(4-2)32(29,30)20-8-9-21(24-15-20)31-17-22(28)26-12-10-25(11-13-26)16-18-6-5-7-19(23)14-18/h5-9,14-15H,3-4,10-13,16-17H2,1-2H3