[4-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-(4-methylphenyl)methanone

Systemtic Name: [4-[(3-chloranyl-6-fluoranyl-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]-(4-methylphenyl)methanone Openeye Name: [4-(3-chloro-6-fluoro-benzothiophene-2-carbonyl)piperazin-1-yl]-(p-tolyl)methanone CAS Name: [4-[(3-chloro-6-fluoro-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]-(4-methylphenyl)methanone IUPAC Name: [4-(3-chloro-6-fluoro-1-benzothiophene-2-carbonyl)piperazin-1-yl]-(4-methylphenyl)methanone Traditional Name: [4-(3-chloro-6-fluoro-benzothiophene-2-carbonyl)piperazino]-(p-tolyl)methanone Formula: C21H18ClFN2O2S MolecularWeight: 416.896223

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=C(C4=C(S3)C=C(C=C4)F)Cl

InChI

InChI=1S/C21H18ClFN2O2S/c1-13-2-4-14(5-3-13)20(26)24-8-10-25(11-9-24)21(27)19-18(22)16-7-6-15(23)12-17(16)28-19/h2-7,12H,8-11H2,1H3