6-[2-(4-oxidanyl-2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethylamino]-N-phenethyl-hexanamide

Systemtic Name: 6-[2-(4-oxidanyl-2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethylamino]-N-phenethyl-hexanamide Openeye Name: 6-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethylamino]-N-phenethyl-hexanamide CAS Name: 6-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethylamino]-N-phenethylhexanamide IUPAC Name: 6-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethylamino]-N-phenethylhexanamide Traditional Name: 6-[2-(4-hydroxy-2-keto-3H-1,3-benzothiazol-7-yl)ethylamino]-N-phenethyl-hexanamide Formula: C23H29N3O3S MolecularWeight: 427.55966

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CCCCCNCCC2=C3C(=C(C=C2)O)NC(=O)S3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CCCCCNCCC2=C3C(=C(C=C2)O)NC(=O)S3

InChI

InChI=1S/C23H29N3O3S/c27-19-11-10-18(22-21(19)26-23(29)30-22)13-15-24-14-6-2-5-9-20(28)25-16-12-17-7-3-1-4-8-17/h1,3-4,7-8,10-11,24,27H,2,5-6,9,12-16H2,(H,25,28)(H,26,29)