N-(1,1,1,2,3,3,3-heptadeuteriopropan-2-ylcarbamothioyl)benzamide

Systemtic Name: N-(1,1,1,2,3,3,3-heptadeuteriopropan-2-ylcarbamothioyl)benzamide Openeye Name: N-[[1,2,2,2-tetradeuterio-1-(trideuteriomethyl)ethyl]carbamothioyl]benzamide CAS Name: N-[(1,1,1,2,3,3,3-heptadeuteriopropan-2-ylamino)-sulfanylidenemethyl]benzamide IUPAC Name: N-(1,1,1,2,3,3,3-heptadeuteriopropan-2-ylcarbamothioyl)benzamide Traditional Name: N-[[1,2,2,2-tetradeuterio-1-(trideuteriomethyl)ethyl]thiocarbamoyl]benzamide Formula: C11H14N2OS MolecularWeight: 229.349792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

[2H]C([2H])([2H])C([2H])(C([2H])([2H])[2H])NC(=S)NC(=O)C1=CC=CC=C1

InChI

InChI=1S/C11H14N2OS/c1-8(2)12-11(15)13-10(14)9-6-4-3-5-7-9/h3-8H,1-2H3,(H2,12,13,14,15)/i1D3,2D3,8D