4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(4-propan-2-yloxyphenyl)methyl]pyrrolidin-3-yl]-2-fluoranyl-benzamide

Systemtic Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(4-propan-2-yloxyphenyl)methyl]pyrrolidin-3-yl]-2-fluoranyl-benzamide Openeye Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(4-isopropoxyphenyl)methyl]pyrrolidin-3-yl]-2-fluoro-benzamide CAS Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(4-propan-2-yloxyphenyl)methyl]-3-pyrrolidinyl]-2-fluorobenzamide IUPAC Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(4-propan-2-yloxyphenyl)methyl]pyrrolidin-3-yl]-2-fluorobenzamide Traditional Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(4-isopropoxyphenyl)methyl]pyrrolidin-3-yl]-2-fluoro-benzamide Formula: C29H27FN4O2 MolecularWeight: 482.548683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(C2=CC=C(C=C2)C#N)N3CCC(C3)NC(=O)C4=C(C=C(C=C4)C#N)F

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C(C2=CC=C(C=C2)C#N)N3CC[C@H](C3)NC(=O)C4=C(C=C(C=C4)C#N)F

InChI

InChI=1S/C29H27FN4O2/c1-19(2)36-25-10-8-23(9-11-25)28(22-6-3-20(16-31)4-7-22)34-14-13-24(18-34)33-29(35)26-12-5-21(17-32)15-27(26)30/h3-12,15,19,24,28H,13-14,18H2,1-2H3,(H,33,35)/t24-,28?/m1/s1