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

Systemtic Name: 4-chloranyl-N-[[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl]benzamide Openeye Name: 4-chloro-N-[(2-methyl-5-oxazolo[4,5-b]pyridin-2-yl-phenyl)carbamothioyl]benzamide CAS Name: 4-chloro-N-[[2-methyl-5-(2-oxazolo[4,5-b]pyridinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-chloro-N-[[2-methyl-5-([1,3]oxazolo[4,5-b]pyridin-2-yl)phenyl]carbamothioyl]benzamide Traditional Name: 4-chloro-N-[(2-methyl-5-oxazolo[4,5-b]pyridin-2-yl-phenyl)thiocarbamoyl]benzamide Formula: C21H15ClN4O2S MolecularWeight: 422.8874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC=N3)NC(=S)NC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC=N3)NC(=S)NC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H15ClN4O2S/c1-12-4-5-14(20-25-18-17(28-20)3-2-10-23-18)11-16(12)24-21(29)26-19(27)13-6-8-15(22)9-7-13/h2-11H,1H3,(H2,24,26,27,29)