1-[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]-3-(2-propan-2-ylphenoxy)propan-2-ol

Systemtic Name: 1-[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]-3-(2-propan-2-ylphenoxy)propan-2-ol Openeye Name: 1-[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]-3-(2-isopropylphenoxy)propan-2-ol CAS Name: 1-[4-[1-(1,3-benzothiazol-2-yl)ethyl]-1-piperazinyl]-3-(2-propan-2-ylphenoxy)-2-propanol IUPAC Name: 1-[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]-3-(2-propan-2-ylphenoxy)propan-2-ol Traditional Name: 1-[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazino]-3-(2-isopropylphenoxy)propan-2-ol Formula: C25H33N3O2S MolecularWeight: 439.61342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OCC(CN2CCN(CC2)C(C)C3=NC4=CC=CC=C4S3)O

Isomeric SMILES

CC(C)C1=CC=CC=C1OCC(CN2CCN(CC2)C(C)C3=NC4=CC=CC=C4S3)O

InChI

InChI=1S/C25H33N3O2S/c1-18(2)21-8-4-6-10-23(21)30-17-20(29)16-27-12-14-28(15-13-27)19(3)25-26-22-9-5-7-11-24(22)31-25/h4-11,18-20,29H,12-17H2,1-3H3