N-butyl-N-methyl-4-[4-(4-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-butyl-N-methyl-4-[4-(4-methylsulfanyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-butyl-N-methyl-4-[4-(4-methylsulfanyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-butyl-N-methyl-4-[[4-[4-(methylthio)-1,3-benzothiazol-2-yl]-1-piperazinyl]-oxomethyl]benzenesulfonamide IUPAC Name: N-butyl-N-methyl-4-[4-(4-methylsulfanyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-butyl-N-methyl-4-[4-[4-(methylthio)-1,3-benzothiazol-2-yl]piperazine-1-carbonyl]benzenesulfonamide Formula: C24H30N4O3S3 MolecularWeight: 518.715

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=CC=C4SC

Isomeric SMILES

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=CC=C4SC

InChI

InChI=1S/C24H30N4O3S3/c1-4-5-13-26(2)34(30,31)19-11-9-18(10-12-19)23(29)27-14-16-28(17-15-27)24-25-22-20(32-3)7-6-8-21(22)33-24/h6-12H,4-5,13-17H2,1-3H3