3-butoxy-N-[[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[(2-methyl-5-oxazolo[4,5-b]pyridin-2-yl-phenyl)carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[2-methyl-5-(2-oxazolo[4,5-b]pyridinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[(2-methyl-5-oxazolo[4,5-b]pyridin-2-yl-phenyl)thiocarbamoyl]benzamide Formula: C25H24N4O3S MolecularWeight: 460.54806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C3=NC4=C(O3)C=CC=N4)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC(=C2)C3=NC4=C(O3)C=CC=N4)C

InChI

InChI=1S/C25H24N4O3S/c1-3-4-13-31-19-8-5-7-17(14-19)23(30)29-25(33)27-20-15-18(11-10-16(20)2)24-28-22-21(32-24)9-6-12-26-22/h5-12,14-15H,3-4,13H2,1-2H3,(H2,27,29,30,33)