3-[4-[3-(4-methoxyphenoxy)-3-phenyl-propyl]piperazin-1-yl]-1,2-benzothiazole

Systemtic Name: 3-[4-[3-(4-methoxyphenoxy)-3-phenyl-propyl]piperazin-1-yl]-1,2-benzothiazole Openeye Name: 3-[4-[3-(4-methoxyphenoxy)-3-phenyl-propyl]piperazin-1-yl]-1,2-benzothiazole CAS Name: 3-[4-[3-(4-methoxyphenoxy)-3-phenylpropyl]-1-piperazinyl]-1,2-benzothiazole IUPAC Name: 3-[4-[3-(4-methoxyphenoxy)-3-phenylpropyl]piperazin-1-yl]-1,2-benzothiazole Traditional Name: 3-[4-[3-(4-methoxyphenoxy)-3-phenyl-propyl]piperazino]-1,2-benzothiazole Formula: C27H29N3O2S MolecularWeight: 459.60306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC(CCN2CCN(CC2)C3=NSC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)OC(CCN2CCN(CC2)C3=NSC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C27H29N3O2S/c1-31-22-11-13-23(14-12-22)32-25(21-7-3-2-4-8-21)15-16-29-17-19-30(20-18-29)27-24-9-5-6-10-26(24)33-28-27/h2-14,25H,15-20H2,1H3