N-(1,3-benzothiazol-2-yl)-5-octanoyl-2-oxidanyl-benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-5-octanoyl-2-oxidanyl-benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-hydroxy-5-octanoyl-benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-hydroxy-5-(1-oxooctyl)benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-hydroxy-5-octanoylbenzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-5-caprylyl-2-hydroxy-benzamide Formula: C22H24N2O3S MolecularWeight: 396.50256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)C1=CC(=C(C=C1)O)C(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCCCCCC(=O)C1=CC(=C(C=C1)O)C(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C22H24N2O3S/c1-2-3-4-5-6-10-18(25)15-12-13-19(26)16(14-15)21(27)24-22-23-17-9-7-8-11-20(17)28-22/h7-9,11-14,26H,2-6,10H2,1H3,(H,23,24,27)