2-(2,4-dimethylphenyl)-1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone

Systemtic Name: 2-(2,4-dimethylphenyl)-1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Openeye Name: 2-(2,4-dimethylphenyl)-1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone CAS Name: 2-(2,4-dimethylphenyl)-1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]ethanone IUPAC Name: 2-(2,4-dimethylphenyl)-1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]ethanone Traditional Name: 2-(2,4-dimethylphenyl)-1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazino]ethanone Formula: C23H27N3O2S MolecularWeight: 409.54438

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)CC4=C(C=C(C=C4)C)C

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)CC4=C(C=C(C=C4)C)C

InChI

InChI=1S/C23H27N3O2S/c1-4-28-19-6-5-7-20-22(19)24-23(29-20)26-12-10-25(11-13-26)21(27)15-18-9-8-16(2)14-17(18)3/h5-9,14H,4,10-13,15H2,1-3H3