N-[2-(4-oxidanyl-2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethyl]-4-phenethyloxy-butanamide

Systemtic Name: N-[2-(4-oxidanyl-2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethyl]-4-phenethyloxy-butanamide Openeye Name: N-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethyl]-4-phenethyloxy-butanamide CAS Name: N-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethyl]-4-phenethyloxybutanamide IUPAC Name: N-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethyl]-4-phenethyloxybutanamide Traditional Name: N-[2-(4-hydroxy-2-keto-3H-1,3-benzothiazol-7-yl)ethyl]-4-phenethyloxy-butyramide Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCOCCCC(=O)NCCC2=C3C(=C(C=C2)O)NC(=O)S3

Isomeric SMILES

C1=CC=C(C=C1)CCOCCCC(=O)NCCC2=C3C(=C(C=C2)O)NC(=O)S3

InChI

InChI=1S/C21H24N2O4S/c24-17-9-8-16(20-19(17)23-21(26)28-20)10-12-22-18(25)7-4-13-27-14-11-15-5-2-1-3-6-15/h1-3,5-6,8-9,24H,4,7,10-14H2,(H,22,25)(H,23,26)