4-cyano-N-[(3R)-1-[(4-ethoxyphenyl)-(6-propan-2-yloxypyridin-3-yl)methyl]pyrrolidin-3-yl]-2-fluoranyl-benzamide

Systemtic Name: 4-cyano-N-[(3R)-1-[(4-ethoxyphenyl)-(6-propan-2-yloxypyridin-3-yl)methyl]pyrrolidin-3-yl]-2-fluoranyl-benzamide Openeye Name: 4-cyano-N-[(3R)-1-[(4-ethoxyphenyl)-(6-isopropoxy-3-pyridyl)methyl]pyrrolidin-3-yl]-2-fluoro-benzamide CAS Name: 4-cyano-N-[(3R)-1-[(4-ethoxyphenyl)-(6-propan-2-yloxy-3-pyridinyl)methyl]-3-pyrrolidinyl]-2-fluorobenzamide IUPAC Name: 4-cyano-N-[(3R)-1-[(4-ethoxyphenyl)-(6-propan-2-yloxypyridin-3-yl)methyl]pyrrolidin-3-yl]-2-fluorobenzamide Traditional Name: 4-cyano-2-fluoro-N-[(3R)-1-[(6-isopropoxy-3-pyridyl)-p-phenetyl-methyl]pyrrolidin-3-yl]benzamide Formula: C29H31FN4O3 MolecularWeight: 502.579843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C2=CN=C(C=C2)OC(C)C)N3CCC(C3)NC(=O)C4=C(C=C(C=C4)C#N)F

Isomeric SMILES

CCOC1=CC=C(C=C1)C(C2=CN=C(C=C2)OC(C)C)N3CC[C@H](C3)NC(=O)C4=C(C=C(C=C4)C#N)F

InChI

InChI=1S/C29H31FN4O3/c1-4-36-24-9-6-21(7-10-24)28(22-8-12-27(32-17-22)37-19(2)3)34-14-13-23(18-34)33-29(35)25-11-5-20(16-31)15-26(25)30/h5-12,15,17,19,23,28H,4,13-14,18H2,1-3H3,(H,33,35)/t23-,28?/m1/s1