2-(4-fluorophenyl)sulfonyl-N-(4-phenylbutan-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: 2-(4-fluorophenyl)sulfonyl-N-(4-phenylbutan-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: 2-(4-fluorophenyl)sulfonyl-N-(1-methyl-3-phenyl-propyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: 2-(4-fluorophenyl)sulfonyl-N-(4-phenylbutan-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: 2-(4-fluorophenyl)sulfonyl-N-(4-phenylbutan-2-yl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: 2-(4-fluorophenyl)sulfonyl-N-(1-methyl-3-phenyl-propyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C26H27FN2O3S MolecularWeight: 466.567583

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C2CC3=CC=CC=C3CN2S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H27FN2O3S/c1-19(11-12-20-7-3-2-4-8-20)28-26(30)25-17-21-9-5-6-10-22(21)18-29(25)33(31,32)24-15-13-23(27)14-16-24/h2-10,13-16,19,25H,11-12,17-18H2,1H3,(H,28,30)