[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-(4-phenylmethoxyphenyl)methanone

Systemtic Name: [4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-(4-phenylmethoxyphenyl)methanone Openeye Name: [4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-(4-benzyloxyphenyl)methanone CAS Name: [4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-(4-phenylmethoxyphenyl)methanone IUPAC Name: [4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-(4-phenylmethoxyphenyl)methanone Traditional Name: [4-(1,3-benzothiazol-2-ylmethyl)piperazino]-(4-benzoxyphenyl)methanone Formula: C26H25N3O2S MolecularWeight: 443.5606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3S2)C(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3S2)C(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C26H25N3O2S/c30-26(21-10-12-22(13-11-21)31-19-20-6-2-1-3-7-20)29-16-14-28(15-17-29)18-25-27-23-8-4-5-9-24(23)32-25/h1-13H,14-19H2