propan-2-yl (2S)-2-[(3-chloranyl-4-fluoranyl-phenyl)-(cyclopropylcarbamothioyl)amino]propanoate

Systemtic Name: propan-2-yl (2S)-2-[(3-chloranyl-4-fluoranyl-phenyl)-(cyclopropylcarbamothioyl)amino]propanoate Openeye Name: isopropyl (2S)-2-[3-chloro-N-(cyclopropylcarbamothioyl)-4-fluoro-anilino]propanoate CAS Name: (2S)-2-(3-chloro-N-[(cyclopropylamino)-sulfanylidenemethyl]-4-fluoroanilino)propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (2S)-2-[3-chloro-N-(cyclopropylcarbamothioyl)-4-fluoroanilino]propanoate Traditional Name: (2S)-2-[3-chloro-N-(cyclopropylthiocarbamoyl)-4-fluoro-anilino]propionic acid isopropyl ester Formula: C16H20ClFN2O2S MolecularWeight: 358.858603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(C)N(C1=CC(=C(C=C1)F)Cl)C(=S)NC2CC2

Isomeric SMILES

C[C@@H](C(=O)OC(C)C)N(C1=CC(=C(C=C1)F)Cl)C(=S)NC2CC2

InChI

InChI=1S/C16H20ClFN2O2S/c1-9(2)22-15(21)10(3)20(16(23)19-11-4-5-11)12-6-7-14(18)13(17)8-12/h6-11H,4-5H2,1-3H3,(H,19,23)/t10-/m0/s1