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

Systemtic Name: N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)-1,3-benzothiazole-6-carboxamide Openeye Name: N-[2-ethoxy-5-(1-piperidylsulfonyl)phenyl]-1,3-benzothiazole-6-carboxamide CAS Name: N-[2-ethoxy-5-(1-piperidinylsulfonyl)phenyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)-1,3-benzothiazole-6-carboxamide Traditional Name: N-(2-ethoxy-5-piperidinosulfonyl-phenyl)-1,3-benzothiazole-6-carboxamide Formula: C21H23N3O4S2 MolecularWeight: 445.55502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC4=C(C=C3)N=CS4

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C21H23N3O4S2/c1-2-28-19-9-7-16(30(26,27)24-10-4-3-5-11-24)13-18(19)23-21(25)15-6-8-17-20(12-15)29-14-22-17/h6-9,12-14H,2-5,10-11H2,1H3,(H,23,25)