N-[[(2S)-3-methyl-1-(oxidanylamino)-1-oxidanylidene-butan-2-yl]-(phenylmethyl)carbamothioyl]benzamide

Systemtic Name: N-[[(2S)-3-methyl-1-(oxidanylamino)-1-oxidanylidene-butan-2-yl]-(phenylmethyl)carbamothioyl]benzamide Openeye Name: N-[benzyl-[(1S)-1-(hydroxycarbamoyl)-2-methyl-propyl]carbamothioyl]benzamide CAS Name: N-[[[(2S)-1-(hydroxyamino)-3-methyl-1-oxobutan-2-yl]-(phenylmethyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[benzyl-[(2S)-1-(hydroxyamino)-3-methyl-1-oxobutan-2-yl]carbamothioyl]benzamide Traditional Name: N-[benzyl-[(1S)-1-(hydroxycarbamoyl)-2-methyl-propyl]thiocarbamoyl]benzamide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NO)N(CC1=CC=CC=C1)C(=S)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)NO)N(CC1=CC=CC=C1)C(=S)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H23N3O3S/c1-14(2)17(19(25)22-26)23(13-15-9-5-3-6-10-15)20(27)21-18(24)16-11-7-4-8-12-16/h3-12,14,17,26H,13H2,1-2H3,(H,22,25)(H,21,24,27)/t17-/m0/s1