5-ethylsulfonyl-3-[[3-(hydroxymethyl)piperidin-1-yl]methyl]-1,3-benzoxazole-2-thione

Systemtic Name: 5-ethylsulfonyl-3-[[3-(hydroxymethyl)piperidin-1-yl]methyl]-1,3-benzoxazole-2-thione Openeye Name: 5-ethylsulfonyl-3-[[3-(hydroxymethyl)-1-piperidyl]methyl]-1,3-benzoxazole-2-thione CAS Name: 5-ethylsulfonyl-3-[[3-(hydroxymethyl)-1-piperidinyl]methyl]-1,3-benzoxazole-2-thione IUPAC Name: 5-ethylsulfonyl-3-[[3-(hydroxymethyl)piperidin-1-yl]methyl]-1,3-benzoxazole-2-thione Traditional Name: 5-esyl-3-[(3-methylolpiperidino)methyl]-1,3-benzoxazole-2-thione Formula: C16H22N2O4S2 MolecularWeight: 370.48688

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=S)N2CN3CCCC(C3)CO

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=S)N2CN3CCCC(C3)CO

InChI

InChI=1S/C16H22N2O4S2/c1-2-24(20,21)13-5-6-15-14(8-13)18(16(23)22-15)11-17-7-3-4-12(9-17)10-19/h5-6,8,12,19H,2-4,7,9-11H2,1H3