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

Systemtic Name: 4-fluoranyl-N-[(2S)-1-[2-(3-methoxypropylcarbamothioyl)-2-methyl-hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: 4-fluoro-N-[(1S)-1-[[3-methoxypropylcarbamothioyl(methyl)amino]carbamoyl]-2-methyl-propyl]benzamide CAS Name: 4-fluoro-N-[(2S)-1-[2-[(3-methoxypropylamino)-sulfanylidenemethyl]-2-methylhydrazinyl]-3-methyl-1-oxobutan-2-yl]benzamide IUPAC Name: 4-fluoro-N-[(2S)-1-[2-(3-methoxypropylcarbamothioyl)-2-methylhydrazinyl]-3-methyl-1-oxobutan-2-yl]benzamide Traditional Name: 4-fluoro-N-[(1S)-1-[[3-methoxypropylthiocarbamoyl(methyl)amino]carbamoyl]-2-methyl-propyl]benzamide Formula: C18H27FN4O3S MolecularWeight: 398.495383

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NN(C)C(=S)NCCCOC)NC(=O)C1=CC=C(C=C1)F

Isomeric SMILES

CC(C)[C@@H](C(=O)NN(C)C(=S)NCCCOC)NC(=O)C1=CC=C(C=C1)F

InChI

InChI=1S/C18H27FN4O3S/c1-12(2)15(21-16(24)13-6-8-14(19)9-7-13)17(25)22-23(3)18(27)20-10-5-11-26-4/h6-9,12,15H,5,10-11H2,1-4H3,(H,20,27)(H,21,24)(H,22,25)/t15-/m0/s1