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

Systemtic Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(6-ethoxypyridin-3-yl)methyl]pyrrolidin-3-yl]benzamide Openeye Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(6-ethoxy-3-pyridyl)methyl]pyrrolidin-3-yl]benzamide CAS Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(6-ethoxy-3-pyridinyl)methyl]-3-pyrrolidinyl]benzamide IUPAC Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(6-ethoxypyridin-3-yl)methyl]pyrrolidin-3-yl]benzamide Traditional Name: 4-cyano-N-[(3R)-1-[(4-cyanophenyl)-(6-ethoxy-3-pyridyl)methyl]pyrrolidin-3-yl]benzamide Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25N5O2/c1-2-34-25-12-11-23(17-30-25)26(21-7-3-19(15-28)4-8-21)32-14-13-24(18-32)31-27(33)22-9-5-20(16-29)6-10-22/h3-12,17,24,26H,2,13-14,18H2,1H3,(H,31,33)/t24-,26?/m1/s1