(phenylmethyl) N-[(2S)-1-[2-(tert-butylcarbamothioyl)hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-1-[2-(tert-butylcarbamothioyl)hydrazinyl]-3-methyl-1-oxidanylidene-butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-1-[(tert-butylcarbamothioylamino)carbamoyl]-2-methyl-propyl]carbamate CAS Name: N-[(2S)-1-[[(tert-butylamino)-sulfanylidenemethyl]hydrazo]-3-methyl-1-oxobutan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-1-[2-(tert-butylcarbamothioyl)hydrazinyl]-3-methyl-1-oxobutan-2-yl]carbamate Traditional Name: N-[(1S)-1-[(tert-butylthiocarbamoylamino)carbamoyl]-2-methyl-propyl]carbamic acid benzyl ester Formula: C18H28N4O3S MolecularWeight: 380.50492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NNC(=S)NC(C)(C)C)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)[C@@H](C(=O)NNC(=S)NC(C)(C)C)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C18H28N4O3S/c1-12(2)14(15(23)21-22-16(26)20-18(3,4)5)19-17(24)25-11-13-9-7-6-8-10-13/h6-10,12,14H,11H2,1-5H3,(H,19,24)(H,21,23)(H2,20,22,26)/t14-/m0/s1