[4-(4-fluorophenyl)piperazin-1-yl]-(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone

Systemtic Name: [4-(4-fluorophenyl)piperazin-1-yl]-(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone Openeye Name: [4-(4-fluorophenyl)piperazin-1-yl]-[2-(2-thienylsulfonyl)-3,4-dihydro-1H-isoquinolin-3-yl]methanone CAS Name: [4-(4-fluorophenyl)-1-piperazinyl]-(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone IUPAC Name: [4-(4-fluorophenyl)piperazin-1-yl]-(2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)methanone Traditional Name: [4-(4-fluorophenyl)piperazino]-[2-(2-thienylsulfonyl)-3,4-dihydro-1H-isoquinolin-3-yl]methanone Formula: C24H24FN3O3S2 MolecularWeight: 485.594063

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)C3CC4=CC=CC=C4CN3S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)C3CC4=CC=CC=C4CN3S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C24H24FN3O3S2/c25-20-7-9-21(10-8-20)26-11-13-27(14-12-26)24(29)22-16-18-4-1-2-5-19(18)17-28(22)33(30,31)23-6-3-15-32-23/h1-10,15,22H,11-14,16-17H2