N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-2,4-dimethyl-benzamide

Systemtic Name: N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-2,4-dimethyl-benzamide Openeye Name: N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-2,4-dimethyl-benzamide CAS Name: N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-2,4-dimethylbenzamide IUPAC Name: N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-2,4-dimethylbenzamide Traditional Name: N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]-2,4-dimethyl-benzamide Formula: C24H23FN2O3S MolecularWeight: 438.514423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=C(C=C4)F)C=C2)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC2=CC3=C(CCN(C3)S(=O)(=O)C4=CC=C(C=C4)F)C=C2)C

InChI

InChI=1S/C24H23FN2O3S/c1-16-3-10-23(17(2)13-16)24(28)26-21-7-4-18-11-12-27(15-19(18)14-21)31(29,30)22-8-5-20(25)6-9-22/h3-10,13-14H,11-12,15H2,1-2H3,(H,26,28)