N-butyl-4-[4-(6-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonyl-N-ethyl-benzenesulfonamide

Systemtic Name: N-butyl-4-[4-(6-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonyl-N-ethyl-benzenesulfonamide Openeye Name: N-butyl-4-[4-(6-chloro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]-N-ethyl-benzenesulfonamide CAS Name: N-butyl-4-[[4-(6-chloro-1,3-benzothiazol-2-yl)-1-piperazinyl]-oxomethyl]-N-ethylbenzenesulfonamide IUPAC Name: N-butyl-4-[4-(6-chloro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]-N-ethylbenzenesulfonamide Traditional Name: N-butyl-4-[4-(6-chloro-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]-N-ethyl-benzenesulfonamide Formula: C24H29ClN4O3S2 MolecularWeight: 521.09506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)Cl

Isomeric SMILES

CCCCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)Cl

InChI

InChI=1S/C24H29ClN4O3S2/c1-3-5-12-29(4-2)34(31,32)20-9-6-18(7-10-20)23(30)27-13-15-28(16-14-27)24-26-21-11-8-19(25)17-22(21)33-24/h6-11,17H,3-5,12-16H2,1-2H3