3-(1-ethylsulfonylpiperidin-4-yl)-5-[5-[[[(2S)-2-methyl-3-oxidanyl-propyl]amino]methyl]thiophen-3-yl]-1H-indole-7-carboxamide

Systemtic Name: 3-(1-ethylsulfonylpiperidin-4-yl)-5-[5-[[[(2S)-2-methyl-3-oxidanyl-propyl]amino]methyl]thiophen-3-yl]-1H-indole-7-carboxamide Openeye Name: 3-(1-ethylsulfonyl-4-piperidyl)-5-[5-[[[(2S)-3-hydroxy-2-methyl-propyl]amino]methyl]-3-thienyl]-1H-indole-7-carboxamide CAS Name: 3-(1-ethylsulfonyl-4-piperidinyl)-5-[5-[[[(2S)-3-hydroxy-2-methylpropyl]amino]methyl]-3-thiophenyl]-1H-indole-7-carboxamide IUPAC Name: 3-(1-ethylsulfonylpiperidin-4-yl)-5-[5-[[[(2S)-3-hydroxy-2-methylpropyl]amino]methyl]thiophen-3-yl]-1H-indole-7-carboxamide Traditional Name: 3-(1-esyl-4-piperidyl)-5-[5-[[[(2S)-3-hydroxy-2-methyl-propyl]amino]methyl]-3-thienyl]-1H-indole-7-carboxamide Formula: C25H34N4O4S2 MolecularWeight: 518.69186

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCC(CC1)C2=CNC3=C(C=C(C=C23)C4=CSC(=C4)CNCC(C)CO)C(=O)N

Isomeric SMILES

CCS(=O)(=O)N1CCC(CC1)C2=CNC3=C(C=C(C=C23)C4=CSC(=C4)CNC[C@H](C)CO)C(=O)N

InChI

InChI=1S/C25H34N4O4S2/c1-3-35(32,33)29-6-4-17(5-7-29)23-13-28-24-21(23)9-18(10-22(24)25(26)31)19-8-20(34-15-19)12-27-11-16(2)14-30/h8-10,13,15-17,27-28,30H,3-7,11-12,14H2,1-2H3,(H2,26,31)/t16-/m0/s1