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

Systemtic Name: 7-[4-[(3-fluoranyl-4-methyl-phenyl)methyl]phenyl]sulfonyl-8-methoxy-3-methyl-1,2,4,5-tetrahydro-3-benzazepine Openeye Name: 7-[4-[(3-fluoro-4-methyl-phenyl)methyl]phenyl]sulfonyl-8-methoxy-3-methyl-1,2,4,5-tetrahydro-3-benzazepine CAS Name: 7-[4-[(3-fluoro-4-methylphenyl)methyl]phenyl]sulfonyl-8-methoxy-3-methyl-1,2,4,5-tetrahydro-3-benzazepine IUPAC Name: 7-[4-[(3-fluoro-4-methylphenyl)methyl]phenyl]sulfonyl-8-methoxy-3-methyl-1,2,4,5-tetrahydro-3-benzazepine Traditional Name: 7-[4-(3-fluoro-4-methyl-benzyl)phenyl]sulfonyl-8-methoxy-3-methyl-1,2,4,5-tetrahydro-3-benzazepine Formula: C26H28FNO3S MolecularWeight: 453.568823

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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)OC)F

Isomeric SMILES

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

InChI

InChI=1S/C26H28FNO3S/c1-18-4-5-20(15-24(18)27)14-19-6-8-23(9-7-19)32(29,30)26-17-22-11-13-28(2)12-10-21(22)16-25(26)31-3/h4-9,15-17H,10-14H2,1-3H3