1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-(4-fluorophenyl)sulfanyl-propan-1-one

Systemtic Name: 1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-(4-fluorophenyl)sulfanyl-propan-1-one Openeye Name: 1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-(4-fluorophenyl)sulfanyl-propan-1-one CAS Name: 1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]-3-[(4-fluorophenyl)thio]-1-propanone IUPAC Name: 1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-(4-fluorophenyl)sulfanylpropan-1-one Traditional Name: 1-[4-(4-ethoxy-1,3-benzothiazol-2-yl)piperazino]-3-[(4-fluorophenyl)thio]propan-1-one Formula: C22H24FN3O2S2 MolecularWeight: 445.573263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)CCSC4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)CCSC4=CC=C(C=C4)F

InChI

InChI=1S/C22H24FN3O2S2/c1-2-28-18-4-3-5-19-21(18)24-22(30-19)26-13-11-25(12-14-26)20(27)10-15-29-17-8-6-16(23)7-9-17/h3-9H,2,10-15H2,1H3