N-[(2S)-1-[2-[(4-fluorophenyl)carbamothioyl]hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide

Systemtic Name: N-[(2S)-1-[2-[(4-fluorophenyl)carbamothioyl]hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide Openeye Name: N-[(1S)-1-[[(4-fluorophenyl)carbamothioylamino]carbamoyl]-2-methyl-propyl]-2-methyl-benzamide CAS Name: N-[(2S)-1-[[(4-fluoroanilino)-sulfanylidenemethyl]hydrazo]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide IUPAC Name: N-[(2S)-1-[2-[(4-fluorophenyl)carbamothioyl]hydrazinyl]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide Traditional Name: N-[(1S)-1-[[(4-fluorophenyl)thiocarbamoylamino]carbamoyl]-2-methyl-propyl]-2-methyl-benzamide Formula: C20H23FN4O2S MolecularWeight: 402.485623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)NNC(=S)NC2=CC=C(C=C2)F

Isomeric SMILES

CC1=CC=CC=C1C(=O)N[C@@H](C(C)C)C(=O)NNC(=S)NC2=CC=C(C=C2)F

InChI

InChI=1S/C20H23FN4O2S/c1-12(2)17(23-18(26)16-7-5-4-6-13(16)3)19(27)24-25-20(28)22-15-10-8-14(21)9-11-15/h4-12,17H,1-3H3,(H,23,26)(H,24,27)(H2,22,25,28)/t17-/m0/s1