4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(6-cyclobutyloxypyridin-3-yl)methyl]pyrrolidin-3-yl]benzamide

Systemtic Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(6-cyclobutyloxypyridin-3-yl)methyl]pyrrolidin-3-yl]benzamide Openeye Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-[6-(cyclobutoxy)-3-pyridyl]methyl]pyrrolidin-3-yl]benzamide CAS Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(6-cyclobutyloxy-3-pyridinyl)methyl]-3-pyrrolidinyl]benzamide IUPAC Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(6-cyclobutyloxypyridin-3-yl)methyl]pyrrolidin-3-yl]benzamide Traditional Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-[6-(cyclobutoxy)-3-pyridyl]methyl]pyrrolidin-3-yl]benzamide Formula: C29H27N5O2 MolecularWeight: 477.55698

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)OC2=NC=C(C=C2)C(C3=CC=C(C=C3)C#N)N4CCC(C4)NC(=O)C5=CC=C(C=C5)C#N

Isomeric SMILES

C1CC(C1)OC2=NC=C(C=C2)C(C3=CC=C(C=C3)C#N)N4CC[C@H](C4)NC(=O)C5=CC=C(C=C5)C#N

InChI

InChI=1S/C29H27N5O2/c30-16-20-4-8-22(9-5-20)28(24-12-13-27(32-18-24)36-26-2-1-3-26)34-15-14-25(19-34)33-29(35)23-10-6-21(17-31)7-11-23/h4-13,18,25-26,28H,1-3,14-15,19H2,(H,33,35)/t25-,28?/m1/s1