1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(4-tert-butylphenoxy)propan-2-ol

Systemtic Name: 1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(4-tert-butylphenoxy)propan-2-ol Openeye Name: 1-[4-(1,3-benzothiazol-2-yl)-1-piperidyl]-3-(4-tert-butylphenoxy)propan-2-ol CAS Name: 1-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-3-(4-tert-butylphenoxy)-2-propanol IUPAC Name: 1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(4-tert-butylphenoxy)propan-2-ol Traditional Name: 1-[4-(1,3-benzothiazol-2-yl)piperidino]-3-(4-tert-butylphenoxy)propan-2-ol Formula: C25H32N2O2S MolecularWeight: 424.59878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(CN2CCC(CC2)C3=NC4=CC=CC=C4S3)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(CN2CCC(CC2)C3=NC4=CC=CC=C4S3)O

InChI

InChI=1S/C25H32N2O2S/c1-25(2,3)19-8-10-21(11-9-19)29-17-20(28)16-27-14-12-18(13-15-27)24-26-22-6-4-5-7-23(22)30-24/h4-11,18,20,28H,12-17H2,1-3H3