1-[4-(4,5-dimethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-phenyl-propan-1-one

Systemtic Name: 1-[4-(4,5-dimethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-phenyl-propan-1-one Openeye Name: 1-[4-(4,5-dimethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-phenyl-propan-1-one CAS Name: 1-[4-(4,5-dimethoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]-3-phenyl-1-propanone IUPAC Name: 1-[4-(4,5-dimethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-phenylpropan-1-one Traditional Name: 1-[4-(4,5-dimethoxy-1,3-benzothiazol-2-yl)piperazino]-3-phenyl-propan-1-one Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)SC(=N2)N3CCN(CC3)C(=O)CCC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)SC(=N2)N3CCN(CC3)C(=O)CCC4=CC=CC=C4)OC

InChI

InChI=1S/C22H25N3O3S/c1-27-17-9-10-18-20(21(17)28-2)23-22(29-18)25-14-12-24(13-15-25)19(26)11-8-16-6-4-3-5-7-16/h3-7,9-10H,8,11-15H2,1-2H3