4-(1,3-benzothiazol-2-yl)-N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-(2-ethoxy-5-piperidin-1-ylsulfonyl-phenyl)butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[2-ethoxy-5-(1-piperidylsulfonyl)phenyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[2-ethoxy-5-(1-piperidinylsulfonyl)phenyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-(2-ethoxy-5-piperidinosulfonyl-phenyl)butyramide Formula: C24H29N3O4S2 MolecularWeight: 487.63476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)CCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H29N3O4S2/c1-2-31-21-14-13-18(33(29,30)27-15-6-3-7-16-27)17-20(21)25-23(28)11-8-12-24-26-19-9-4-5-10-22(19)32-24/h4-5,9-10,13-14,17H,2-3,6-8,11-12,15-16H2,1H3,(H,25,28)