N-(2,6-diethylphenyl)-3-methyl-6-thiophen-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide

Systemtic Name: N-(2,6-diethylphenyl)-3-methyl-6-thiophen-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide Openeye Name: N-(2,6-diethylphenyl)-3-methyl-6-(2-thienyl)isoxazolo[5,4-b]pyridine-4-carboxamide CAS Name: N-(2,6-diethylphenyl)-3-methyl-6-thiophen-2-yl-4-isoxazolo[5,4-b]pyridinecarboxamide IUPAC Name: N-(2,6-diethylphenyl)-3-methyl-6-thiophen-2-yl-[1,2]oxazolo[5,4-b]pyridine-4-carboxamide Traditional Name: N-(2,6-diethylphenyl)-3-methyl-6-(2-thienyl)isoxazolo[5,4-b]pyridine-4-carboxamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)C2=CC(=NC3=C2C(=NO3)C)C4=CC=CS4

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)C2=CC(=NC3=C2C(=NO3)C)C4=CC=CS4

InChI

InChI=1S/C22H21N3O2S/c1-4-14-8-6-9-15(5-2)20(14)24-21(26)16-12-17(18-10-7-11-28-18)23-22-19(16)13(3)25-27-22/h6-12H,4-5H2,1-3H3,(H,24,26)