N-[2-[[(3S,4S)-1-[4-(6-ethoxypyridin-3-yl)-4-oxidanyl-cyclohexyl]-4-oxidanyl-pyrrolidin-3-yl]amino]-2-oxidanylidene-ethyl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[2-[[(3S,4S)-1-[4-(6-ethoxypyridin-3-yl)-4-oxidanyl-cyclohexyl]-4-oxidanyl-pyrrolidin-3-yl]amino]-2-oxidanylidene-ethyl]-3-(trifluoromethyl)benzamide Openeye Name: N-[2-[[(3S,4S)-1-[4-(6-ethoxy-3-pyridyl)-4-hydroxy-cyclohexyl]-4-hydroxy-pyrrolidin-3-yl]amino]-2-oxo-ethyl]-3-(trifluoromethyl)benzamide CAS Name: N-[2-[[(3S,4S)-1-[4-(6-ethoxy-3-pyridinyl)-4-hydroxycyclohexyl]-4-hydroxy-3-pyrrolidinyl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[2-[[(3S,4S)-1-[4-(6-ethoxypyridin-3-yl)-4-hydroxycyclohexyl]-4-hydroxypyrrolidin-3-yl]amino]-2-oxoethyl]-3-(trifluoromethyl)benzamide Traditional Name: N-[2-[[(3S,4S)-1-[4-(6-ethoxy-3-pyridyl)-4-hydroxy-cyclohexyl]-4-hydroxy-pyrrolidin-3-yl]amino]-2-keto-ethyl]-3-(trifluoromethyl)benzamide Formula: C27H33F3N4O5 MolecularWeight: 550.56993

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC=C(C=C1)C2(CCC(CC2)N3CC(C(C3)O)NC(=O)CNC(=O)C4=CC(=CC=C4)C(F)(F)F)O

Isomeric SMILES

CCOC1=NC=C(C=C1)C2(CCC(CC2)N3C[C@@H]([C@H](C3)O)NC(=O)CNC(=O)C4=CC(=CC=C4)C(F)(F)F)O

InChI

InChI=1S/C27H33F3N4O5/c1-2-39-24-7-6-19(13-31-24)26(38)10-8-20(9-11-26)34-15-21(22(35)16-34)33-23(36)14-32-25(37)17-4-3-5-18(12-17)27(28,29)30/h3-7,12-13,20-22,35,38H,2,8-11,14-16H2,1H3,(H,32,37)(H,33,36)/t20?,21-,22-,26?/m0/s1