3-[3-(4-butylpiperidin-1-yl)-2-methyl-3-oxidanyl-propyl]-1,3-benzothiazol-2-one

Systemtic Name: 3-[3-(4-butylpiperidin-1-yl)-2-methyl-3-oxidanyl-propyl]-1,3-benzothiazol-2-one Openeye Name: 3-[3-(4-butyl-1-piperidyl)-3-hydroxy-2-methyl-propyl]-1,3-benzothiazol-2-one CAS Name: 3-[3-(4-butyl-1-piperidinyl)-3-hydroxy-2-methylpropyl]-1,3-benzothiazol-2-one IUPAC Name: 3-[3-(4-butylpiperidin-1-yl)-3-hydroxy-2-methylpropyl]-1,3-benzothiazol-2-one Traditional Name: 3-[3-(4-butylpiperidino)-3-hydroxy-2-methyl-propyl]-1,3-benzothiazol-2-one Formula: C20H30N2O2S MolecularWeight: 362.5294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCN(CC1)C(C(C)CN2C3=CC=CC=C3SC2=O)O

Isomeric SMILES

CCCCC1CCN(CC1)C(C(C)CN2C3=CC=CC=C3SC2=O)O

InChI

InChI=1S/C20H30N2O2S/c1-3-4-7-16-10-12-21(13-11-16)19(23)15(2)14-22-17-8-5-6-9-18(17)25-20(22)24/h5-6,8-9,15-16,19,23H,3-4,7,10-14H2,1-2H3