N-methyl-4-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonyl-N-(phenylmethyl)benzenesulfonamide

Systemtic Name: N-methyl-4-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonyl-N-(phenylmethyl)benzenesulfonamide Openeye Name: N-benzyl-N-methyl-4-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-methyl-4-[[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-oxomethyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-N-methyl-4-[4-(6-methylsulfonyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-benzyl-4-[4-(6-mesyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]-N-methyl-benzenesulfonamide Formula: C27H28N4O5S3 MolecularWeight: 584.73002

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C

Isomeric SMILES

CN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C

InChI

InChI=1S/C27H28N4O5S3/c1-29(19-20-6-4-3-5-7-20)39(35,36)22-10-8-21(9-11-22)26(32)30-14-16-31(17-15-30)27-28-24-13-12-23(38(2,33)34)18-25(24)37-27/h3-13,18H,14-17,19H2,1-2H3