[2-[(2-fluorophenyl)carbamoylamino]-2-oxidanylidene-ethyl] 2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoate

Systemtic Name: [2-[(2-fluorophenyl)carbamoylamino]-2-oxidanylidene-ethyl] 2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoate Openeye Name: [2-[(2-fluorophenyl)carbamoylamino]-2-oxo-ethyl] 2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetate CAS Name: 2-(4-thieno[2,3-d]pyrimidinylthio)acetic acid [2-[[(2-fluoroanilino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-fluorophenyl)carbamoylamino]-2-oxoethyl] 2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetate Traditional Name: 2-(thieno[2,3-d]pyrimidin-4-ylthio)acetic acid [2-[(2-fluorophenyl)carbamoylamino]-2-keto-ethyl] ester Formula: C17H13FN4O4S2 MolecularWeight: 420.437923

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)NC(=O)COC(=O)CSC2=NC=NC3=C2C=CS3)F

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)NC(=O)COC(=O)CSC2=NC=NC3=C2C=CS3)F

InChI

InChI=1S/C17H13FN4O4S2/c18-11-3-1-2-4-12(11)21-17(25)22-13(23)7-26-14(24)8-28-16-10-5-6-27-15(10)19-9-20-16/h1-6,9H,7-8H2,(H2,21,22,23,25)