[2-(2-azanylpyrimidin-4-yl)-4-[bis(fluoranyl)methoxy]phenyl] thiophene-2-carboxylate

Systemtic Name: [2-(2-azanylpyrimidin-4-yl)-4-[bis(fluoranyl)methoxy]phenyl] thiophene-2-carboxylate Openeye Name: [2-(2-aminopyrimidin-4-yl)-4-(difluoromethoxy)phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [2-(2-amino-4-pyrimidinyl)-4-(difluoromethoxy)phenyl] ester IUPAC Name: [2-(2-aminopyrimidin-4-yl)-4-(difluoromethoxy)phenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [2-(2-aminopyrimidin-4-yl)-4-(difluoromethoxy)phenyl] ester Formula: C16H11F2N3O3S MolecularWeight: 363.338646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)OC2=C(C=C(C=C2)OC(F)F)C3=NC(=NC=C3)N

Isomeric SMILES

C1=CSC(=C1)C(=O)OC2=C(C=C(C=C2)OC(F)F)C3=NC(=NC=C3)N

InChI

InChI=1S/C16H11F2N3O3S/c17-15(18)23-9-3-4-12(24-14(22)13-2-1-7-25-13)10(8-9)11-5-6-20-16(19)21-11/h1-8,15H,(H2,19,20,21)