N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(1-piperidylsulfonyl)benzamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-(6-mesyl-1,3-benzothiazol-2-yl)-3-piperidinosulfonyl-benzamide Formula: C20H21N3O5S3 MolecularWeight: 479.59284

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C20H21N3O5S3/c1-30(25,26)15-8-9-17-18(13-15)29-20(21-17)22-19(24)14-6-5-7-16(12-14)31(27,28)23-10-3-2-4-11-23/h5-9,12-13H,2-4,10-11H2,1H3,(H,21,22,24)