(4-bromanyl-2-pyrrolidin-1-ylcarbothioyl-phenyl) 4-fluoranylbenzoate

Systemtic Name: (4-bromanyl-2-pyrrolidin-1-ylcarbothioyl-phenyl) 4-fluoranylbenzoate Openeye Name: [4-bromo-2-(pyrrolidine-1-carbothioyl)phenyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [4-bromo-2-[1-pyrrolidinyl(sulfanylidene)methyl]phenyl] ester IUPAC Name: [4-bromo-2-(pyrrolidine-1-carbothioyl)phenyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [4-bromo-2-(pyrrolidine-1-carbothioyl)phenyl] ester Formula: C18H15BrFNO2S MolecularWeight: 408.284603

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)C2=C(C=CC(=C2)Br)OC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

C1CCN(C1)C(=S)C2=C(C=CC(=C2)Br)OC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H15BrFNO2S/c19-13-5-8-16(15(11-13)17(24)21-9-1-2-10-21)23-18(22)12-3-6-14(20)7-4-12/h3-8,11H,1-2,9-10H2