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

Systemtic Name: 1-methyl-3-[[3-pyridin-3-yl-6-(trifluoromethyl)thieno[3,2-b]pyridin-2-yl]carbonylamino]thiourea Openeye Name: 1-methyl-3-[[3-(3-pyridyl)-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carbonyl]amino]thiourea CAS Name: 1-methyl-3-[[oxo-[3-(3-pyridinyl)-6-(trifluoromethyl)-2-thieno[3,2-b]pyridinyl]methyl]amino]thiourea IUPAC Name: 1-methyl-3-[[3-pyridin-3-yl-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carbonyl]amino]thiourea Traditional Name: 1-methyl-3-[[3-(3-pyridyl)-6-(trifluoromethyl)thieno[3,2-b]pyridine-2-carbonyl]amino]thiourea Formula: C16H12F3N5OS2 MolecularWeight: 411.42459

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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=CN=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C16H12F3N5OS2/c1-20-15(26)24-23-14(25)13-11(8-3-2-4-21-6-8)12-10(27-13)5-9(7-22-12)16(17,18)19/h2-7H,1H3,(H,23,25)(H2,20,24,26)