N-[(1S)-3-[4-[ethyl-[2-(4-methylsulfonylphenyl)ethanoyl]amino]piperidin-1-yl]-1-phenyl-propyl]-5-(trifluoromethyl)furan-2-carboxamide

Systemtic Name: N-[(1S)-3-[4-[ethyl-[2-(4-methylsulfonylphenyl)ethanoyl]amino]piperidin-1-yl]-1-phenyl-propyl]-5-(trifluoromethyl)furan-2-carboxamide Openeye Name: N-[(1S)-3-[4-[ethyl-[2-(4-methylsulfonylphenyl)acetyl]amino]-1-piperidyl]-1-phenyl-propyl]-5-(trifluoromethyl)furan-2-carboxamide CAS Name: N-[(1S)-3-[4-[ethyl-[2-(4-methylsulfonylphenyl)-1-oxoethyl]amino]-1-piperidinyl]-1-phenylpropyl]-5-(trifluoromethyl)-2-furancarboxamide IUPAC Name: N-[(1S)-3-[4-[ethyl-[2-(4-methylsulfonylphenyl)acetyl]amino]piperidin-1-yl]-1-phenylpropyl]-5-(trifluoromethyl)furan-2-carboxamide Traditional Name: N-[(1S)-3-[4-[ethyl-[2-(4-mesylphenyl)acetyl]amino]piperidino]-1-phenyl-propyl]-5-(trifluoromethyl)-2-furamide Formula: C31H36F3N3O5S MolecularWeight: 619.69485

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(CC1)CCC(C2=CC=CC=C2)NC(=O)C3=CC=C(O3)C(F)(F)F)C(=O)CC4=CC=C(C=C4)S(=O)(=O)C

Isomeric SMILES

CCN(C1CCN(CC1)CC[C@@H](C2=CC=CC=C2)NC(=O)C3=CC=C(O3)C(F)(F)F)C(=O)CC4=CC=C(C=C4)S(=O)(=O)C

InChI

InChI=1S/C31H36F3N3O5S/c1-3-37(29(38)21-22-9-11-25(12-10-22)43(2,40)41)24-15-18-36(19-16-24)20-17-26(23-7-5-4-6-8-23)35-30(39)27-13-14-28(42-27)31(32,33)34/h4-14,24,26H,3,15-21H2,1-2H3,(H,35,39)/t26-/m0/s1