5-oxidanyl-7-[1-oxidanyl-2-(phenethylamino)ethyl]-3H-1,3-benzothiazol-2-one

Systemtic Name: 5-oxidanyl-7-[1-oxidanyl-2-(phenethylamino)ethyl]-3H-1,3-benzothiazol-2-one Openeye Name: 5-hydroxy-7-[1-hydroxy-2-(phenethylamino)ethyl]-3H-1,3-benzothiazol-2-one CAS Name: 5-hydroxy-7-[1-hydroxy-2-(phenethylamino)ethyl]-3H-1,3-benzothiazol-2-one IUPAC Name: 5-hydroxy-7-[1-hydroxy-2-(phenethylamino)ethyl]-3H-1,3-benzothiazol-2-one Traditional Name: 5-hydroxy-7-[1-hydroxy-2-(phenethylamino)ethyl]-3H-1,3-benzothiazol-2-one Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNCC(C2=CC(=CC3=C2SC(=O)N3)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCNCC(C2=CC(=CC3=C2SC(=O)N3)O)O

InChI

InChI=1S/C17H18N2O3S/c20-12-8-13(16-14(9-12)19-17(22)23-16)15(21)10-18-7-6-11-4-2-1-3-5-11/h1-5,8-9,15,18,20-21H,6-7,10H2,(H,19,22)