N-tert-butyl-2-[(4-chlorophenyl)carbamothioylamino]ethanamide

Systemtic Name: N-tert-butyl-2-[(4-chlorophenyl)carbamothioylamino]ethanamide Openeye Name: N-tert-butyl-2-[(4-chlorophenyl)carbamothioylamino]acetamide CAS Name: N-tert-butyl-2-[[(4-chloroanilino)-sulfanylidenemethyl]amino]acetamide IUPAC Name: N-tert-butyl-2-[(4-chlorophenyl)carbamothioylamino]acetamide Traditional Name: N-tert-butyl-2-[(4-chlorophenyl)thiocarbamoylamino]acetamide Formula: C13H18ClN3OS MolecularWeight: 299.81952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)CNC(=S)NC1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C)(C)NC(=O)CNC(=S)NC1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H18ClN3OS/c1-13(2,3)17-11(18)8-15-12(19)16-10-6-4-9(14)5-7-10/h4-7H,8H2,1-3H3,(H,17,18)(H2,15,16,19)