[4-[5-(3,4-dihydro-1H-isoquinolin-2-yl)-4-fluoranyl-2-nitro-phenyl]piperazin-1-yl]-thiophen-2-yl-methanone

Systemtic Name: [4-[5-(3,4-dihydro-1H-isoquinolin-2-yl)-4-fluoranyl-2-nitro-phenyl]piperazin-1-yl]-thiophen-2-yl-methanone Openeye Name: [4-[5-(3,4-dihydro-1H-isoquinolin-2-yl)-4-fluoro-2-nitro-phenyl]piperazin-1-yl]-(2-thienyl)methanone CAS Name: [4-[5-(3,4-dihydro-1H-isoquinolin-2-yl)-4-fluoro-2-nitrophenyl]-1-piperazinyl]-thiophen-2-ylmethanone IUPAC Name: [4-[5-(3,4-dihydro-1H-isoquinolin-2-yl)-4-fluoro-2-nitrophenyl]piperazin-1-yl]-thiophen-2-ylmethanone Traditional Name: [4-[5-(3,4-dihydro-1H-isoquinolin-2-yl)-4-fluoro-2-nitro-phenyl]piperazino]-(2-thienyl)methanone Formula: C24H23FN4O3S MolecularWeight: 466.527823

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C(=C3)N4CCN(CC4)C(=O)C5=CC=CS5)[N+](=O)[O-])F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C(=C3)N4CCN(CC4)C(=O)C5=CC=CS5)[N+](=O)[O-])F

InChI

InChI=1S/C24H23FN4O3S/c25-19-14-22(29(31)32)21(15-20(19)28-8-7-17-4-1-2-5-18(17)16-28)26-9-11-27(12-10-26)24(30)23-6-3-13-33-23/h1-6,13-15H,7-12,16H2