N-(4-bromanyl-2-methyl-phenyl)-2-(prop-2-enylcarbamothioylamino)ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-(prop-2-enylcarbamothioylamino)ethanamide Openeye Name: 2-(allylcarbamothioylamino)-N-(4-bromo-2-methyl-phenyl)acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-(prop-2-enylcarbamothioylamino)acetamide Traditional Name: 2-(allylthiocarbamoylamino)-N-(4-bromo-2-methyl-phenyl)acetamide Formula: C13H16BrN3OS MolecularWeight: 342.25464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16BrN3OS/c1-3-6-15-13(19)16-8-12(18)17-11-5-4-10(14)7-9(11)2/h3-5,7H,1,6,8H2,2H3,(H,17,18)(H2,15,16,19)