methyl 2-ethyl-5-fluoranyl-4-(methylsulfonylamino)-1-piperidin-4-yl-indole-3-carboxylate

Systemtic Name: methyl 2-ethyl-5-fluoranyl-4-(methylsulfonylamino)-1-piperidin-4-yl-indole-3-carboxylate Openeye Name: methyl 2-ethyl-5-fluoro-4-(methanesulfonamido)-1-(4-piperidyl)indole-3-carboxylate CAS Name: 2-ethyl-5-fluoro-4-(methanesulfonamido)-1-(4-piperidinyl)-3-indolecarboxylic acid methyl ester IUPAC Name: methyl 2-ethyl-5-fluoro-4-(methanesulfonamido)-1-piperidin-4-ylindole-3-carboxylate Traditional Name: 2-ethyl-5-fluoro-4-(methanesulfonamido)-1-(4-piperidyl)indole-3-carboxylic acid methyl ester Formula: C18H24FN3O4S MolecularWeight: 397.464263

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N1C3CCNCC3)C=CC(=C2NS(=O)(=O)C)F)C(=O)OC

Isomeric SMILES

CCC1=C(C2=C(N1C3CCNCC3)C=CC(=C2NS(=O)(=O)C)F)C(=O)OC

InChI

InChI=1S/C18H24FN3O4S/c1-4-13-16(18(23)26-2)15-14(22(13)11-7-9-20-10-8-11)6-5-12(19)17(15)21-27(3,24)25/h5-6,11,20-21H,4,7-10H2,1-3H3