N'-(4,6-dimethylpyrimidin-2-yl)-2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carbohydrazide

Systemtic Name: N'-(4,6-dimethylpyrimidin-2-yl)-2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carbohydrazide Openeye Name: N'-(4,6-dimethylpyrimidin-2-yl)-2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carbohydrazide CAS Name: N'-(4,6-dimethyl-2-pyrimidinyl)-2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carbohydrazide IUPAC Name: N'-(4,6-dimethylpyrimidin-2-yl)-2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carbohydrazide Traditional Name: N'-(4,6-dimethylpyrimidin-2-yl)-2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinoline-3-carbohydrazide Formula: C22H22FN5O3S MolecularWeight: 455.505183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NNC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=CC(=NC(=N1)NNC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C22H22FN5O3S/c1-14-11-15(2)25-22(24-14)27-26-21(29)20-12-16-5-3-4-6-17(16)13-28(20)32(30,31)19-9-7-18(23)8-10-19/h3-11,20H,12-13H2,1-2H3,(H,26,29)(H,24,25,27)