3-azanyl-N-(2,4-dimethylphenyl)-6-(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-N-(2,4-dimethylphenyl)-6-(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-N-(2,4-dimethylphenyl)-6-(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-N-(2,4-dimethylphenyl)-6-(4-fluorophenyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-N-(2,4-dimethylphenyl)-6-(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-N-(2,4-dimethylphenyl)-6-(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C22H18FN3OS MolecularWeight: 391.461223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=C(C3=C(S2)N=C(C=C3)C4=CC=C(C=C4)F)N)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=C(C3=C(S2)N=C(C=C3)C4=CC=C(C=C4)F)N)C

InChI

InChI=1S/C22H18FN3OS/c1-12-3-9-17(13(2)11-12)25-21(27)20-19(24)16-8-10-18(26-22(16)28-20)14-4-6-15(23)7-5-14/h3-11H,24H2,1-2H3,(H,25,27)