N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-6-propan-2-yl-thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-6-propan-2-yl-thieno[2,3-b]pyridine-2-carboxamide Openeye Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-6-isopropyl-thieno[2,3-b]pyridine-2-carboxamide CAS Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-6-propan-2-yl-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: N-[3-cyano-4-(2,2-dimethylpropoxy)phenyl]-6-propan-2-ylthieno[2,3-b]pyridine-2-carboxamide Traditional Name: N-(3-cyano-4-neopentyloxy-phenyl)-6-isopropyl-thieno[2,3-b]pyridine-2-carboxamide Formula: C23H25N3O2S MolecularWeight: 407.5285

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C=C1)C=C(S2)C(=O)NC3=CC(=C(C=C3)OCC(C)(C)C)C#N

Isomeric SMILES

CC(C)C1=NC2=C(C=C1)C=C(S2)C(=O)NC3=CC(=C(C=C3)OCC(C)(C)C)C#N

InChI

InChI=1S/C23H25N3O2S/c1-14(2)18-8-6-15-11-20(29-22(15)26-18)21(27)25-17-7-9-19(16(10-17)12-24)28-13-23(3,4)5/h6-11,14H,13H2,1-5H3,(H,25,27)