N-[2,2,2-tris(chloranyl)-1-[(4-ethoxyphenyl)carbamothioylamino]ethyl]hexanamide

Systemtic Name: N-[2,2,2-tris(chloranyl)-1-[(4-ethoxyphenyl)carbamothioylamino]ethyl]hexanamide Openeye Name: N-[2,2,2-trichloro-1-[(4-ethoxyphenyl)carbamothioylamino]ethyl]hexanamide CAS Name: N-[2,2,2-trichloro-1-[[(4-ethoxyanilino)-sulfanylidenemethyl]amino]ethyl]hexanamide IUPAC Name: N-[2,2,2-trichloro-1-[(4-ethoxyphenyl)carbamothioylamino]ethyl]hexanamide Traditional Name: N-[2,2,2-trichloro-1-(p-phenetylthiocarbamoylamino)ethyl]hexanamide Formula: C17H24Cl3N3O2S MolecularWeight: 440.81536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC1=CC=C(C=C1)OCC

Isomeric SMILES

CCCCCC(=O)NC(C(Cl)(Cl)Cl)NC(=S)NC1=CC=C(C=C1)OCC

InChI

InChI=1S/C17H24Cl3N3O2S/c1-3-5-6-7-14(24)22-15(17(18,19)20)23-16(26)21-12-8-10-13(11-9-12)25-4-2/h8-11,15H,3-7H2,1-2H3,(H,22,24)(H2,21,23,26)