(2,7-dimethylquinolin-3-yl)-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (2,7-dimethylquinolin-3-yl)-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (2,7-dimethyl-3-quinolyl)-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (2,7-dimethyl-3-quinolinyl)-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (2,7-dimethylquinolin-3-yl)-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (2,7-dimethyl-3-quinolyl)-[4-(3-fluorophenyl)sulfonylpiperazino]methanone Formula: C22H22FN3O3S MolecularWeight: 427.491783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F)C

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC(=C4)F)C

InChI

InChI=1S/C22H22FN3O3S/c1-15-6-7-17-13-20(16(2)24-21(17)12-15)22(27)25-8-10-26(11-9-25)30(28,29)19-5-3-4-18(23)14-19/h3-7,12-14H,8-11H2,1-2H3