N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxy-phenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: N-[2-isopropoxy-5-(1-piperidylsulfonyl)phenyl]-1,3-benzothiazole-6-carboxamide CAS Name: N-[5-(1-piperidinylsulfonyl)-2-propan-2-yloxyphenyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(5-piperidin-1-ylsulfonyl-2-propan-2-yloxyphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-isopropoxy-5-piperidinosulfonyl-phenyl)-1,3-benzothiazole-6-carboxamide Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC4=C(C=C3)N=CS4

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C22H25N3O4S2/c1-15(2)29-20-9-7-17(31(27,28)25-10-4-3-5-11-25)13-19(20)24-22(26)16-6-8-18-21(12-16)30-14-23-18/h6-9,12-15H,3-5,10-11H2,1-2H3,(H,24,26)