1-[4-(4-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(4-fluorophenyl)sulfanyl-ethanone

Systemtic Name: 1-[4-(4-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(4-fluorophenyl)sulfanyl-ethanone Openeye Name: 1-[4-(4-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(4-fluorophenyl)sulfanyl-ethanone CAS Name: 1-[4-(4-ethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-2-[(4-fluorophenyl)thio]ethanone IUPAC Name: 1-[4-(4-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(4-fluorophenyl)sulfanylethanone Traditional Name: 1-[4-(4-ethyl-1,3-benzothiazol-2-yl)piperazino]-2-[(4-fluorophenyl)thio]ethanone Formula: C21H22FN3OS2 MolecularWeight: 415.547283

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)CSC4=CC=C(C=C4)F

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)CSC4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FN3OS2/c1-2-15-4-3-5-18-20(15)23-21(28-18)25-12-10-24(11-13-25)19(26)14-27-17-8-6-16(22)7-9-17/h3-9H,2,10-14H2,1H3