N-(2,6-dimethylphenyl)-2-[[(2S)-2-ethylhexyl]carbamothioylamino]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[[(2S)-2-ethylhexyl]carbamothioylamino]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[[(2S)-2-ethylhexyl]carbamothioylamino]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[[[[(2S)-2-ethylhexyl]amino]-sulfanylidenemethyl]amino]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[[(2S)-2-ethylhexyl]carbamothioylamino]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[[(2S)-2-ethylhexyl]thiocarbamoylamino]acetamide Formula: C19H31N3OS MolecularWeight: 349.53394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=S)NCC(=O)NC1=C(C=CC=C1C)C

Isomeric SMILES

CCCC[C@H](CC)CNC(=S)NCC(=O)NC1=C(C=CC=C1C)C

InChI

InChI=1S/C19H31N3OS/c1-5-7-11-16(6-2)12-20-19(24)21-13-17(23)22-18-14(3)9-8-10-15(18)4/h8-10,16H,5-7,11-13H2,1-4H3,(H,22,23)(H2,20,21,24)/t16-/m0/s1