2-[3-cyano-4-(4-dimethylaminophenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-[[(2R)-oxolan-2-yl]methyl]ethanamide

Systemtic Name: 2-[3-cyano-4-(4-dimethylaminophenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-[[(2R)-oxolan-2-yl]methyl]ethanamide Openeye Name: 2-[[3-cyano-4-(4-dimethylaminophenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]acetamide CAS Name: 2-[[3-cyano-4-(4-dimethylaminophenyl)-6-phenyl-2-pyridinyl]thio]-N-[[(2R)-2-oxolanyl]methyl]acetamide IUPAC Name: 2-[3-cyano-4-(4-dimethylaminophenyl)-6-phenylpyridin-2-yl]sulfanyl-N-[[(2R)-oxolan-2-yl]methyl]acetamide Traditional Name: 2-[[3-cyano-4-(4-dimethylaminophenyl)-6-phenyl-2-pyridyl]thio]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]acetamide Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)NCC3CCCO3)C4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)NC[C@H]3CCCO3)C4=CC=CC=C4

InChI

InChI=1S/C27H28N4O2S/c1-31(2)21-12-10-19(11-13-21)23-15-25(20-7-4-3-5-8-20)30-27(24(23)16-28)34-18-26(32)29-17-22-9-6-14-33-22/h3-5,7-8,10-13,15,22H,6,9,14,17-18H2,1-2H3,(H,29,32)/t22-/m1/s1