2-(4-methoxyphenyl)-N-(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-(4-methoxyphenyl)-N-(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-(4-methoxyphenyl)-N-[6-(1-piperidylsulfonyl)-1,3-benzothiazol-2-yl]acetamide CAS Name: 2-(4-methoxyphenyl)-N-[6-(1-piperidinylsulfonyl)-1,3-benzothiazol-2-yl]acetamide IUPAC Name: 2-(4-methoxyphenyl)-N-(6-piperidin-1-ylsulfonyl-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-(4-methoxyphenyl)-N-(6-piperidinosulfonyl-1,3-benzothiazol-2-yl)acetamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)CC(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C21H23N3O4S2/c1-28-16-7-5-15(6-8-16)13-20(25)23-21-22-18-10-9-17(14-19(18)29-21)30(26,27)24-11-3-2-4-12-24/h5-10,14H,2-4,11-13H2,1H3,(H,22,23,25)