2-[4-[(Z)-N-(butylcarbamothioylamino)-C-methyl-carbonimidoyl]phenoxy]-N-phenyl-ethanamide

Systemtic Name: 2-[4-[(Z)-N-(butylcarbamothioylamino)-C-methyl-carbonimidoyl]phenoxy]-N-phenyl-ethanamide Openeye Name: 2-[4-[(Z)-N-(butylcarbamothioylamino)-C-methyl-carbonimidoyl]phenoxy]-N-phenyl-acetamide CAS Name: 2-[4-[(1Z)-1-[[butylamino(sulfanylidene)methyl]hydrazinylidene]ethyl]phenoxy]-N-phenylacetamide IUPAC Name: 2-[4-[(Z)-N-(butylcarbamothioylamino)-C-methylcarbonimidoyl]phenoxy]-N-phenylacetamide Traditional Name: 2-[4-[(Z)-N-(butylthiocarbamoylamino)-C-methyl-carbonimidoyl]phenoxy]-N-phenyl-acetamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=C(C)C1=CC=C(C=C1)OCC(=O)NC2=CC=CC=C2

Isomeric SMILES

CCCCNC(=S)N/N=C(/C)\C1=CC=C(C=C1)OCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C21H26N4O2S/c1-3-4-14-22-21(28)25-24-16(2)17-10-12-19(13-11-17)27-15-20(26)23-18-8-6-5-7-9-18/h5-13H,3-4,14-15H2,1-2H3,(H,23,26)(H2,22,25,28)/b24-16-