quinolin-2-ylmethyl 2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: quinolin-2-ylmethyl 2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: 2-quinolylmethyl 2-[2-(4-fluoroanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(4-fluoroanilino)-2-oxoethyl]thio]acetic acid 2-quinolinylmethyl ester IUPAC Name: quinolin-2-ylmethyl 2-[2-(4-fluoroanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(4-fluoroanilino)-2-keto-ethyl]thio]acetic acid 2-quinolylmethyl ester Formula: C20H17FN2O3S MolecularWeight: 384.423983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)COC(=O)CSCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)COC(=O)CSCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H17FN2O3S/c21-15-6-9-16(10-7-15)23-19(24)12-27-13-20(25)26-11-17-8-5-14-3-1-2-4-18(14)22-17/h1-10H,11-13H2,(H,23,24)