9-[3,5-bis(fluoranyl)phenyl]sulfonyl-5,6-dimethyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indole

Systemtic Name: 9-[3,5-bis(fluoranyl)phenyl]sulfonyl-5,6-dimethyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indole Openeye Name: 9-(3,5-difluorophenyl)sulfonyl-5,6-dimethyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indole CAS Name: 9-(3,5-difluorophenyl)sulfonyl-5,6-dimethyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indole IUPAC Name: 9-(3,5-difluorophenyl)sulfonyl-5,6-dimethyl-2,3,4,5-tetrahydro-1H-azepino[4,5-b]indole Traditional Name: 9-(3,5-difluorophenyl)sulfonyl-5,6-dimethyl-2,3,4,5-tetrahydro-1H-azepin[4,5-b]indole Formula: C20H20F2N2O2S MolecularWeight: 390.446806

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCCC2=C1N(C3=C2C=C(C=C3)S(=O)(=O)C4=CC(=CC(=C4)F)F)C

Isomeric SMILES

CC1CNCCC2=C1N(C3=C2C=C(C=C3)S(=O)(=O)C4=CC(=CC(=C4)F)F)C

InChI

InChI=1S/C20H20F2N2O2S/c1-12-11-23-6-5-17-18-10-15(3-4-19(18)24(2)20(12)17)27(25,26)16-8-13(21)7-14(22)9-16/h3-4,7-10,12,23H,5-6,11H2,1-2H3