4-[[[(2S)-2-ethylhexyl]carbamothioyl-methyl-amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[[(2S)-2-ethylhexyl]carbamothioyl-methyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[[(2S)-2-ethylhexyl]carbamothioyl-methyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[[[[(2S)-2-ethylhexyl]amino]-sulfanylidenemethyl]-methylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[[(2S)-2-ethylhexyl]carbamothioyl-methylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[[(2S)-2-ethylhexyl]thiocarbamoyl-methyl-amino]methyl]-N-methyl-benzamide Formula: C19H31N3OS MolecularWeight: 349.53394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=S)N(C)CC1=CC=C(C=C1)C(=O)NC

Isomeric SMILES

CCCC[C@H](CC)CNC(=S)N(C)CC1=CC=C(C=C1)C(=O)NC

InChI

InChI=1S/C19H31N3OS/c1-5-7-8-15(6-2)13-21-19(24)22(4)14-16-9-11-17(12-10-16)18(23)20-3/h9-12,15H,5-8,13-14H2,1-4H3,(H,20,23)(H,21,24)/t15-/m0/s1