[(2R)-1-[(2-fluorophenyl)carbamothioylamino]-3-phenyl-propan-2-yl]-dimethyl-azanium

Systemtic Name: [(2R)-1-[(2-fluorophenyl)carbamothioylamino]-3-phenyl-propan-2-yl]-dimethyl-azanium Openeye Name: [(1R)-1-benzyl-2-[(2-fluorophenyl)carbamothioylamino]ethyl]-dimethyl-ammonium CAS Name: [(2R)-1-[[(2-fluoroanilino)-sulfanylidenemethyl]amino]-3-phenylpropan-2-yl]-dimethylammonium IUPAC Name: [(2R)-1-[(2-fluorophenyl)carbamothioylamino]-3-phenylpropan-2-yl]-dimethylazanium Traditional Name: [(1R)-1-benzyl-2-[(2-fluorophenyl)thiocarbamoylamino]ethyl]-dimethyl-ammonium Formula: C18H23FN3S+ MolecularWeight: 332.458723

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CC1=CC=CC=C1)CNC(=S)NC2=CC=CC=C2F

Isomeric SMILES

C[NH+](C)[C@H](CC1=CC=CC=C1)CNC(=S)NC2=CC=CC=C2F

InChI

InChI=1S/C18H22FN3S/c1-22(2)15(12-14-8-4-3-5-9-14)13-20-18(23)21-17-11-7-6-10-16(17)19/h3-11,15H,12-13H2,1-2H3,(H2,20,21,23)/p+1/t15-/m1/s1