N,N-diethyl-7-[2-fluoranyl-4-(2-phenylethanoylcarbamothioylamino)phenoxy]thieno[3,2-b]pyridine-2-carboxamide

Systemtic Name: N,N-diethyl-7-[2-fluoranyl-4-(2-phenylethanoylcarbamothioylamino)phenoxy]thieno[3,2-b]pyridine-2-carboxamide Openeye Name: N,N-diethyl-7-[2-fluoro-4-[(2-phenylacetyl)carbamothioylamino]phenoxy]thieno[3,2-b]pyridine-2-carboxamide CAS Name: N,N-diethyl-7-[2-fluoro-4-[[[(1-oxo-2-phenylethyl)amino]-sulfanylidenemethyl]amino]phenoxy]-2-thieno[3,2-b]pyridinecarboxamide IUPAC Name: N,N-diethyl-7-[2-fluoro-4-[(2-phenylacetyl)carbamothioylamino]phenoxy]thieno[3,2-b]pyridine-2-carboxamide Traditional Name: N,N-diethyl-7-[2-fluoro-4-[(2-phenylacetyl)thiocarbamoylamino]phenoxy]thieno[3,2-b]pyridine-2-carboxamide Formula: C27H25FN4O3S2 MolecularWeight: 536.640803

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC2=NC=CC(=C2S1)OC3=C(C=C(C=C3)NC(=S)NC(=O)CC4=CC=CC=C4)F

Isomeric SMILES

CCN(CC)C(=O)C1=CC2=NC=CC(=C2S1)OC3=C(C=C(C=C3)NC(=S)NC(=O)CC4=CC=CC=C4)F

InChI

InChI=1S/C27H25FN4O3S2/c1-3-32(4-2)26(34)23-16-20-25(37-23)22(12-13-29-20)35-21-11-10-18(15-19(21)28)30-27(36)31-24(33)14-17-8-6-5-7-9-17/h5-13,15-16H,3-4,14H2,1-2H3,(H2,30,31,33,36)