5-[3-(ethylaminomethyl)-5-fluoranyl-phenyl]-3-(1-ethylsulfonylpiperidin-4-yl)-1H-indole-7-carboxamide

Systemtic Name: 5-[3-(ethylaminomethyl)-5-fluoranyl-phenyl]-3-(1-ethylsulfonylpiperidin-4-yl)-1H-indole-7-carboxamide Openeye Name: 5-[3-(ethylaminomethyl)-5-fluoro-phenyl]-3-(1-ethylsulfonyl-4-piperidyl)-1H-indole-7-carboxamide CAS Name: 5-[3-(ethylaminomethyl)-5-fluorophenyl]-3-(1-ethylsulfonyl-4-piperidinyl)-1H-indole-7-carboxamide IUPAC Name: 5-[3-(ethylaminomethyl)-5-fluorophenyl]-3-(1-ethylsulfonylpiperidin-4-yl)-1H-indole-7-carboxamide Traditional Name: 3-(1-esyl-4-piperidyl)-5-[3-(ethylaminomethyl)-5-fluoro-phenyl]-1H-indole-7-carboxamide Formula: C25H31FN4O3S MolecularWeight: 486.602043

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1=CC(=CC(=C1)C2=CC(=C3C(=C2)C(=CN3)C4CCN(CC4)S(=O)(=O)CC)C(=O)N)F

Isomeric SMILES

CCNCC1=CC(=CC(=C1)C2=CC(=C3C(=C2)C(=CN3)C4CCN(CC4)S(=O)(=O)CC)C(=O)N)F

InChI

InChI=1S/C25H31FN4O3S/c1-3-28-14-16-9-18(11-20(26)10-16)19-12-21-23(15-29-24(21)22(13-19)25(27)31)17-5-7-30(8-6-17)34(32,33)4-2/h9-13,15,17,28-29H,3-8,14H2,1-2H3,(H2,27,31)