N-[(2R)-1-[2-[(2-fluorophenyl)carbamothioyl]hydrazinyl]-4-methyl-1-oxidanylidene-pentan-2-yl]-2-methyl-benzamide

Systemtic Name: N-[(2R)-1-[2-[(2-fluorophenyl)carbamothioyl]hydrazinyl]-4-methyl-1-oxidanylidene-pentan-2-yl]-2-methyl-benzamide Openeye Name: N-[(1R)-1-[[(2-fluorophenyl)carbamothioylamino]carbamoyl]-3-methyl-butyl]-2-methyl-benzamide CAS Name: N-[(2R)-1-[[(2-fluoroanilino)-sulfanylidenemethyl]hydrazo]-4-methyl-1-oxopentan-2-yl]-2-methylbenzamide IUPAC Name: N-[(2R)-1-[2-[(2-fluorophenyl)carbamothioyl]hydrazinyl]-4-methyl-1-oxopentan-2-yl]-2-methylbenzamide Traditional Name: N-[(1R)-1-[[(2-fluorophenyl)thiocarbamoylamino]carbamoyl]-3-methyl-butyl]-2-methyl-benzamide Formula: C21H25FN4O2S MolecularWeight: 416.512203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(CC(C)C)C(=O)NNC(=S)NC2=CC=CC=C2F

Isomeric SMILES

CC1=CC=CC=C1C(=O)N[C@H](CC(C)C)C(=O)NNC(=S)NC2=CC=CC=C2F

InChI

InChI=1S/C21H25FN4O2S/c1-13(2)12-18(23-19(27)15-9-5-4-8-14(15)3)20(28)25-26-21(29)24-17-11-7-6-10-16(17)22/h4-11,13,18H,12H2,1-3H3,(H,23,27)(H,25,28)(H2,24,26,29)/t18-/m1/s1