9-(4-fluorophenyl)sulfonyl-6-methyl-3-propan-2-yl-1,2,4,5-tetrahydroazepino[4,5-b]indole

Systemtic Name: 9-(4-fluorophenyl)sulfonyl-6-methyl-3-propan-2-yl-1,2,4,5-tetrahydroazepino[4,5-b]indole Openeye Name: 9-(4-fluorophenyl)sulfonyl-3-isopropyl-6-methyl-1,2,4,5-tetrahydroazepino[4,5-b]indole CAS Name: 9-(4-fluorophenyl)sulfonyl-6-methyl-3-propan-2-yl-1,2,4,5-tetrahydroazepino[4,5-b]indole IUPAC Name: 9-(4-fluorophenyl)sulfonyl-6-methyl-3-propan-2-yl-1,2,4,5-tetrahydroazepino[4,5-b]indole Traditional Name: 9-(4-fluorophenyl)sulfonyl-3-isopropyl-6-methyl-1,2,4,5-tetrahydroazepin[4,5-b]indole Formula: C22H25FN2O2S MolecularWeight: 400.509503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC2=C(CC1)N(C3=C2C=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)F)C

Isomeric SMILES

CC(C)N1CCC2=C(CC1)N(C3=C2C=C(C=C3)S(=O)(=O)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C22H25FN2O2S/c1-15(2)25-12-10-19-20-14-18(8-9-21(20)24(3)22(19)11-13-25)28(26,27)17-6-4-16(23)5-7-17/h4-9,14-15H,10-13H2,1-3H3