2-(2-phenylsulfanylethylcarbamothioylamino)-N-(2,4,6-trimethylphenyl)ethanamide

Systemtic Name: 2-(2-phenylsulfanylethylcarbamothioylamino)-N-(2,4,6-trimethylphenyl)ethanamide Openeye Name: 2-(2-phenylsulfanylethylcarbamothioylamino)-N-(2,4,6-trimethylphenyl)acetamide CAS Name: 2-[[[2-(phenylthio)ethylamino]-sulfanylidenemethyl]amino]-N-(2,4,6-trimethylphenyl)acetamide IUPAC Name: 2-(2-phenylsulfanylethylcarbamothioylamino)-N-(2,4,6-trimethylphenyl)acetamide Traditional Name: N-mesityl-2-[2-(phenylthio)ethylthiocarbamoylamino]acetamide Formula: C20H25N3OS2 MolecularWeight: 387.562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CNC(=S)NCCSC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CNC(=S)NCCSC2=CC=CC=C2)C

InChI

InChI=1S/C20H25N3OS2/c1-14-11-15(2)19(16(3)12-14)23-18(24)13-22-20(25)21-9-10-26-17-7-5-4-6-8-17/h4-8,11-12H,9-10,13H2,1-3H3,(H,23,24)(H2,21,22,25)