[2-[[2-[(4-fluorophenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl] pyrrolidine-1-carbodithioate

Systemtic Name: [2-[[2-[(4-fluorophenyl)carbamoyl]phenyl]amino]-2-oxidanylidene-ethyl] pyrrolidine-1-carbodithioate Openeye Name: [2-[2-[(4-fluorophenyl)carbamoyl]anilino]-2-oxo-ethyl] pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [2-[2-[(4-fluoroanilino)-oxomethyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-[(4-fluorophenyl)carbamoyl]anilino]-2-oxoethyl] pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid [2-[2-[(4-fluorophenyl)carbamoyl]anilino]-2-keto-ethyl] ester Formula: C20H20FN3O2S2 MolecularWeight: 417.520103

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)SCC(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1CCN(C1)C(=S)SCC(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H20FN3O2S2/c21-14-7-9-15(10-8-14)22-19(26)16-5-1-2-6-17(16)23-18(25)13-28-20(27)24-11-3-4-12-24/h1-2,5-10H,3-4,11-13H2,(H,22,26)(H,23,25)