[1-[(4-dimethylaminophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(2-fluorophenyl)sulfanylpropanoate

Systemtic Name: [1-[(4-dimethylaminophenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(2-fluorophenyl)sulfanylpropanoate Openeye Name: [2-[4-(dimethylamino)anilino]-1-methyl-2-oxo-ethyl] 3-(2-fluorophenyl)sulfanylpropanoate CAS Name: 3-[(2-fluorophenyl)thio]propanoic acid [1-[4-(dimethylamino)anilino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[4-(dimethylamino)anilino]-1-oxopropan-2-yl] 3-(2-fluorophenyl)sulfanylpropanoate Traditional Name: 3-[(2-fluorophenyl)thio]propionic acid [2-[4-(dimethylamino)anilino]-2-keto-1-methyl-ethyl] ester Formula: C20H23FN2O3S MolecularWeight: 390.471623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N(C)C)OC(=O)CCSC2=CC=CC=C2F

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)N(C)C)OC(=O)CCSC2=CC=CC=C2F

InChI

InChI=1S/C20H23FN2O3S/c1-14(20(25)22-15-8-10-16(11-9-15)23(2)3)26-19(24)12-13-27-18-7-5-4-6-17(18)21/h4-11,14H,12-13H2,1-3H3,(H,22,25)