1-methyl-3-[[3-phenyl-6-(trifluoromethyl)thieno[3,2-b]pyridin-2-yl]carbonylamino]thiourea

Systemtic Name: 1-methyl-3-[[3-phenyl-6-(trifluoromethyl)thieno[3,2-b]pyridin-2-yl]carbonylamino]thiourea Openeye Name: 1-methyl-3-[[3-phenyl-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carbonyl]amino]thiourea CAS Name: 1-methyl-3-[[oxo-[3-phenyl-6-(trifluoromethyl)-2-thieno[3,2-b]pyridinyl]methyl]amino]thiourea IUPAC Name: 1-methyl-3-[[3-phenyl-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carbonyl]amino]thiourea Traditional Name: 1-methyl-3-[[3-phenyl-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carbonyl]amino]thiourea Formula: C17H13F3N4OS2 MolecularWeight: 410.43653

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NNC(=O)C1=C(C2=C(S1)C=C(C=N2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CNC(=S)NNC(=O)C1=C(C2=C(S1)C=C(C=N2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C17H13F3N4OS2/c1-21-16(26)24-23-15(25)14-12(9-5-3-2-4-6-9)13-11(27-14)7-10(8-22-13)17(18,19)20/h2-8H,1H3,(H,23,25)(H2,21,24,26)