(2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]methanone

Systemtic Name: (2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]methanone Openeye Name: (2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)-[4-(2-fluorobenzoyl)piperazin-1-yl]methanone CAS Name: (2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)-[4-[(2-fluorophenyl)-oxomethyl]-1-piperazinyl]methanone IUPAC Name: (2-ethylsulfonyl-3,4-dihydro-1H-isoquinolin-3-yl)-[4-(2-fluorobenzoyl)piperazin-1-yl]methanone Traditional Name: (2-esyl-3,4-dihydro-1H-isoquinolin-3-yl)-[4-(2-fluorobenzoyl)piperazino]methanone Formula: C23H26FN3O4S MolecularWeight: 459.533643

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4F

Isomeric SMILES

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)N3CCN(CC3)C(=O)C4=CC=CC=C4F

InChI

InChI=1S/C23H26FN3O4S/c1-2-32(30,31)27-16-18-8-4-3-7-17(18)15-21(27)23(29)26-13-11-25(12-14-26)22(28)19-9-5-6-10-20(19)24/h3-10,21H,2,11-16H2,1H3