3-tert-butyl-5-cyano-N-[6-methyl-5-(4-phenylmethoxyphenyl)pyridin-3-yl]benzamide

Systemtic Name: 3-tert-butyl-5-cyano-N-[6-methyl-5-(4-phenylmethoxyphenyl)pyridin-3-yl]benzamide Openeye Name: N-[5-(4-benzyloxyphenyl)-6-methyl-3-pyridyl]-3-tert-butyl-5-cyano-benzamide CAS Name: 3-tert-butyl-5-cyano-N-[6-methyl-5-(4-phenylmethoxyphenyl)-3-pyridinyl]benzamide IUPAC Name: 3-tert-butyl-5-cyano-N-[6-methyl-5-(4-phenylmethoxyphenyl)pyridin-3-yl]benzamide Traditional Name: N-[5-(4-benzoxyphenyl)-6-methyl-3-pyridyl]-3-tert-butyl-5-cyano-benzamide Formula: C31H29N3O2 MolecularWeight: 475.58086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1C2=CC=C(C=C2)OCC3=CC=CC=C3)NC(=O)C4=CC(=CC(=C4)C#N)C(C)(C)C

Isomeric SMILES

CC1=NC=C(C=C1C2=CC=C(C=C2)OCC3=CC=CC=C3)NC(=O)C4=CC(=CC(=C4)C#N)C(C)(C)C

InChI

InChI=1S/C31H29N3O2/c1-21-29(24-10-12-28(13-11-24)36-20-22-8-6-5-7-9-22)17-27(19-33-21)34-30(35)25-14-23(18-32)15-26(16-25)31(2,3)4/h5-17,19H,20H2,1-4H3,(H,34,35)