methyl 2-[5-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-3-phenethyl-2-sulfanylidene-imidazolidin-1-yl]ethanoate

Systemtic Name: methyl 2-[5-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-3-phenethyl-2-sulfanylidene-imidazolidin-1-yl]ethanoate Openeye Name: methyl 2-[5-[2-(4-fluoroanilino)-2-oxo-ethyl]-4-oxo-3-phenethyl-2-thioxo-imidazolidin-1-yl]acetate CAS Name: 2-[5-[2-(4-fluoroanilino)-2-oxoethyl]-4-oxo-3-phenethyl-2-sulfanylidene-1-imidazolidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[5-[2-(4-fluoroanilino)-2-oxoethyl]-4-oxo-3-phenethyl-2-sulfanylideneimidazolidin-1-yl]acetate Traditional Name: 2-[5-[2-(4-fluoroanilino)-2-keto-ethyl]-4-keto-3-phenethyl-2-thioxo-imidazolidin-1-yl]acetic acid methyl ester Formula: C22H22FN3O4S MolecularWeight: 443.491183

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(C(=O)N(C1=S)CCC2=CC=CC=C2)CC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

COC(=O)CN1C(C(=O)N(C1=S)CCC2=CC=CC=C2)CC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C22H22FN3O4S/c1-30-20(28)14-26-18(13-19(27)24-17-9-7-16(23)8-10-17)21(29)25(22(26)31)12-11-15-5-3-2-4-6-15/h2-10,18H,11-14H2,1H3,(H,24,27)