propan-2-yl 2-[(2-bromanyl-4-fluoranyl-phenyl)carbamothioylamino]-4-methylsulfanyl-butanoate

Systemtic Name: propan-2-yl 2-[(2-bromanyl-4-fluoranyl-phenyl)carbamothioylamino]-4-methylsulfanyl-butanoate Openeye Name: isopropyl 2-[(2-bromo-4-fluoro-phenyl)carbamothioylamino]-4-methylsulfanyl-butanoate CAS Name: 2-[[(2-bromo-4-fluoroanilino)-sulfanylidenemethyl]amino]-4-(methylthio)butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[(2-bromo-4-fluorophenyl)carbamothioylamino]-4-methylsulfanylbutanoate Traditional Name: 2-[(2-bromo-4-fluoro-phenyl)thiocarbamoylamino]-4-(methylthio)butyric acid isopropyl ester Formula: C15H20BrFN2O2S2 MolecularWeight: 423.363903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CCSC)NC(=S)NC1=C(C=C(C=C1)F)Br

Isomeric SMILES

CC(C)OC(=O)C(CCSC)NC(=S)NC1=C(C=C(C=C1)F)Br

InChI

InChI=1S/C15H20BrFN2O2S2/c1-9(2)21-14(20)13(6-7-23-3)19-15(22)18-12-5-4-10(17)8-11(12)16/h4-5,8-9,13H,6-7H2,1-3H3,(H2,18,19,22)