7-[4-[(3-fluoranyl-4-methyl-phenyl)methyl]phenyl]sulfonyl-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-8-ol

Systemtic Name: 7-[4-[(3-fluoranyl-4-methyl-phenyl)methyl]phenyl]sulfonyl-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-8-ol Openeye Name: 7-[4-[(3-fluoro-4-methyl-phenyl)methyl]phenyl]sulfonyl-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-8-ol CAS Name: 7-[4-[(3-fluoro-4-methylphenyl)methyl]phenyl]sulfonyl-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-8-ol IUPAC Name: 7-[4-[(3-fluoro-4-methylphenyl)methyl]phenyl]sulfonyl-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-8-ol Traditional Name: 7-[4-(3-fluoro-4-methyl-benzyl)phenyl]sulfonyl-3-methyl-1,2,4,5-tetrahydro-3-benzazepin-8-ol Formula: C25H26FNO3S MolecularWeight: 439.542243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2=CC=C(C=C2)S(=O)(=O)C3=C(C=C4CCN(CCC4=C3)C)O)F

Isomeric SMILES

CC1=C(C=C(C=C1)CC2=CC=C(C=C2)S(=O)(=O)C3=C(C=C4CCN(CCC4=C3)C)O)F

InChI

InChI=1S/C25H26FNO3S/c1-17-3-4-19(14-23(17)26)13-18-5-7-22(8-6-18)31(29,30)25-16-21-10-12-27(2)11-9-20(21)15-24(25)28/h3-8,14-16,28H,9-13H2,1-2H3