[4-[(5-fluoranyl-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-(4-methoxyphenyl)methanone

Systemtic Name: [4-[(5-fluoranyl-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-(4-methoxyphenyl)methanone Openeye Name: [4-(5-fluorobenzothiophene-2-carbonyl)piperazin-1-yl]-(4-methoxyphenyl)methanone CAS Name: [4-[(5-fluoro-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]-(4-methoxyphenyl)methanone IUPAC Name: [4-(5-fluoro-1-benzothiophene-2-carbonyl)piperazin-1-yl]-(4-methoxyphenyl)methanone Traditional Name: [4-(5-fluorobenzothiophene-2-carbonyl)piperazino]-(4-methoxyphenyl)methanone Formula: C21H19FN2O3S MolecularWeight: 398.450563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC4=C(S3)C=CC(=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=CC4=C(S3)C=CC(=C4)F

InChI

InChI=1S/C21H19FN2O3S/c1-27-17-5-2-14(3-6-17)20(25)23-8-10-24(11-9-23)21(26)19-13-15-12-16(22)4-7-18(15)28-19/h2-7,12-13H,8-11H2,1H3