6-[(1S,2S)-1-oxidanyl-2-(4-oxidanyl-4-thiophen-2-yl-piperidin-1-yl)propyl]-3H-1,3-benzothiazol-2-one

Systemtic Name: 6-[(1S,2S)-1-oxidanyl-2-(4-oxidanyl-4-thiophen-2-yl-piperidin-1-yl)propyl]-3H-1,3-benzothiazol-2-one Openeye Name: 6-[(1S,2S)-1-hydroxy-2-[4-hydroxy-4-(2-thienyl)-1-piperidyl]propyl]-3H-1,3-benzothiazol-2-one CAS Name: 6-[(1S,2S)-1-hydroxy-2-(4-hydroxy-4-thiophen-2-yl-1-piperidinyl)propyl]-3H-1,3-benzothiazol-2-one IUPAC Name: 6-[(1S,2S)-1-hydroxy-2-(4-hydroxy-4-thiophen-2-ylpiperidin-1-yl)propyl]-3H-1,3-benzothiazol-2-one Traditional Name: 6-[(1S,2S)-1-hydroxy-2-[4-hydroxy-4-(2-thienyl)piperidino]propyl]-3H-1,3-benzothiazol-2-one Formula: C19H22N2O3S2 MolecularWeight: 390.51958

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC2=C(C=C1)NC(=O)S2)O)N3CCC(CC3)(C4=CC=CS4)O

Isomeric SMILES

C[C@@H]([C@H](C1=CC2=C(C=C1)NC(=O)S2)O)N3CCC(CC3)(C4=CC=CS4)O

InChI

InChI=1S/C19H22N2O3S2/c1-12(17(22)13-4-5-14-15(11-13)26-18(23)20-14)21-8-6-19(24,7-9-21)16-3-2-10-25-16/h2-5,10-12,17,22,24H,6-9H2,1H3,(H,20,23)/t12-,17+/m0/s1