1-[4-[(4-fluoranyl-3-methyl-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-2-methyl-propan-1-one

Systemtic Name: 1-[4-[(4-fluoranyl-3-methyl-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-2-methyl-propan-1-one Openeye Name: 1-[4-(4-fluoro-3-methyl-benzothiophene-2-carbonyl)piperazin-1-yl]-2-methyl-propan-1-one CAS Name: 1-[4-[(4-fluoro-3-methyl-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]-2-methyl-1-propanone IUPAC Name: 1-[4-(4-fluoro-3-methyl-1-benzothiophene-2-carbonyl)piperazin-1-yl]-2-methylpropan-1-one Traditional Name: 1-[4-(4-fluoro-3-methyl-benzothiophene-2-carbonyl)piperazino]-2-methyl-propan-1-one Formula: C18H21FN2O2S MolecularWeight: 348.434943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC(=C12)F)C(=O)N3CCN(CC3)C(=O)C(C)C

Isomeric SMILES

CC1=C(SC2=CC=CC(=C12)F)C(=O)N3CCN(CC3)C(=O)C(C)C

InChI

InChI=1S/C18H21FN2O2S/c1-11(2)17(22)20-7-9-21(10-8-20)18(23)16-12(3)15-13(19)5-4-6-14(15)24-16/h4-6,11H,7-10H2,1-3H3