N-(4-bromanyl-2-methyl-phenyl)-2-(furan-2-ylmethylcarbamothioylamino)ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-(furan-2-ylmethylcarbamothioylamino)ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-(2-furylmethylcarbamothioylamino)acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[(2-furanylmethylamino)-sulfanylidenemethyl]amino]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-(furan-2-ylmethylcarbamothioylamino)acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-(2-furfurylthiocarbamoylamino)acetamide Formula: C15H16BrN3O2S MolecularWeight: 382.27544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=S)NCC2=CC=CO2

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CNC(=S)NCC2=CC=CO2

InChI

InChI=1S/C15H16BrN3O2S/c1-10-7-11(16)4-5-13(10)19-14(20)9-18-15(22)17-8-12-3-2-6-21-12/h2-7H,8-9H2,1H3,(H,19,20)(H2,17,18,22)