N-(4-bromanyl-2-methyl-phenyl)-2-[3-(dimethylamino)propylcarbamothioylamino]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[3-(dimethylamino)propylcarbamothioylamino]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[3-(dimethylamino)propylcarbamothioylamino]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[[3-(dimethylamino)propylamino]-sulfanylidenemethyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[3-(dimethylamino)propylcarbamothioylamino]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[3-(dimethylamino)propylthiocarbamoylamino]acetamide Formula: C15H23BrN4OS MolecularWeight: 387.33832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=S)NCCCN(C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=S)NCCCN(C)C

InChI

InChI=1S/C15H23BrN4OS/c1-11-9-12(16)5-6-13(11)19-14(21)10-18-15(22)17-7-4-8-20(2)3/h5-6,9H,4,7-8,10H2,1-3H3,(H,19,21)(H2,17,18,22)