N-(4-bromanyl-2-methyl-phenyl)-2-(propylcarbamothioylamino)ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-(propylcarbamothioylamino)ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-(propylcarbamothioylamino)acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[propylamino(sulfanylidene)methyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-(propylcarbamothioylamino)acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-(propylthiocarbamoylamino)acetamide Formula: C13H18BrN3OS MolecularWeight: 344.27052

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)NCC(=O)NC1=C(C=C(C=C1)Br)C

Isomeric SMILES

CCCNC(=S)NCC(=O)NC1=C(C=C(C=C1)Br)C

InChI

InChI=1S/C13H18BrN3OS/c1-3-6-15-13(19)16-8-12(18)17-11-5-4-10(14)7-9(11)2/h4-5,7H,3,6,8H2,1-2H3,(H,17,18)(H2,15,16,19)