N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-1,3-benzothiazole-6-carboxamide Openeye Name: N-[1-(4-acetamidophenyl)sulfonyl-4-piperidyl]-1,3-benzothiazole-6-carboxamide CAS Name: N-[1-(4-acetamidophenyl)sulfonyl-4-piperidinyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[1-(4-acetamidophenyl)sulfonylpiperidin-4-yl]-1,3-benzothiazole-6-carboxamide Traditional Name: N-[1-(4-acetamidophenyl)sulfonyl-4-piperidyl]-1,3-benzothiazole-6-carboxamide Formula: C21H22N4O4S2 MolecularWeight: 458.55378

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=CC4=C(C=C3)N=CS4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC(=O)C3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C21H22N4O4S2/c1-14(26)23-16-3-5-18(6-4-16)31(28,29)25-10-8-17(9-11-25)24-21(27)15-2-7-19-20(12-15)30-13-22-19/h2-7,12-13,17H,8-11H2,1H3,(H,23,26)(H,24,27)