3-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]carbonyl-4-chloranyl-N,N-dimethyl-benzenesulfonamide

Systemtic Name: 3-[4-(azepan-1-ylsulfonyl)piperazin-1-yl]carbonyl-4-chloranyl-N,N-dimethyl-benzenesulfonamide Openeye Name: 3-[4-(azepan-1-ylsulfonyl)piperazine-1-carbonyl]-4-chloro-N,N-dimethyl-benzenesulfonamide CAS Name: 3-[[4-(1-azepanylsulfonyl)-1-piperazinyl]-oxomethyl]-4-chloro-N,N-dimethylbenzenesulfonamide IUPAC Name: 3-[4-(azepan-1-ylsulfonyl)piperazine-1-carbonyl]-4-chloro-N,N-dimethylbenzenesulfonamide Traditional Name: 3-[4-(azepan-1-ylsulfonyl)piperazine-1-carbonyl]-4-chloro-N,N-dimethyl-benzenesulfonamide Formula: C19H29ClN4O5S2 MolecularWeight: 493.04036

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)N2CCN(CC2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H29ClN4O5S2/c1-21(2)30(26,27)16-7-8-18(20)17(15-16)19(25)22-11-13-24(14-12-22)31(28,29)23-9-5-3-4-6-10-23/h7-8,15H,3-6,9-14H2,1-2H3