N-[(2S)-1-[2-(tert-butylcarbamothioyl)hydrazinyl]-1-oxidanylidene-propan-2-yl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[(2S)-1-[2-(tert-butylcarbamothioyl)hydrazinyl]-1-oxidanylidene-propan-2-yl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[(1S)-2-[2-(tert-butylcarbamothioyl)hydrazino]-1-methyl-2-oxo-ethyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[(2S)-1-[[(tert-butylamino)-sulfanylidenemethyl]hydrazo]-1-oxopropan-2-yl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[(2S)-1-[2-(tert-butylcarbamothioyl)hydrazinyl]-1-oxopropan-2-yl]-3,4,5-trimethoxybenzamide Traditional Name: N-[(1S)-2-[N'-(tert-butylthiocarbamoyl)hydrazino]-2-keto-1-methyl-ethyl]-3,4,5-trimethoxy-benzamide Formula: C18H28N4O5S MolecularWeight: 412.50372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N4O5S/c1-10(15(23)21-22-17(28)20-18(2,3)4)19-16(24)11-8-12(25-5)14(27-7)13(9-11)26-6/h8-10H,1-7H3,(H,19,24)(H,21,23)(H2,20,22,28)/t10-/m0/s1