4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(2-propan-2-yloxypyrimidin-5-yl)methyl]pyrrolidin-3-yl]benzamide

Systemtic Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(2-propan-2-yloxypyrimidin-5-yl)methyl]pyrrolidin-3-yl]benzamide Openeye Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(2-isopropoxypyrimidin-5-yl)methyl]pyrrolidin-3-yl]benzamide CAS Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(2-propan-2-yloxy-5-pyrimidinyl)methyl]-3-pyrrolidinyl]benzamide IUPAC Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(2-propan-2-yloxypyrimidin-5-yl)methyl]pyrrolidin-3-yl]benzamide Traditional Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(2-isopropoxypyrimidin-5-yl)methyl]pyrrolidin-3-yl]benzamide Formula: C27H26N6O2 MolecularWeight: 466.53434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NC=C(C=N1)C(C2=CC=C(C=C2)C#N)N3CCC(C3)NC(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC(C)OC1=NC=C(C=N1)C(C2=CC=C(C=C2)C#N)N3CC[C@H](C3)NC(=O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C27H26N6O2/c1-18(2)35-27-30-15-23(16-31-27)25(21-7-3-19(13-28)4-8-21)33-12-11-24(17-33)32-26(34)22-9-5-20(14-29)6-10-22/h3-10,15-16,18,24-25H,11-12,17H2,1-2H3,(H,32,34)/t24-,25?/m1/s1