2-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoylamino]-N-(furan-2-ylmethyl)ethanamide

Systemtic Name: 2-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoylamino]-N-(furan-2-ylmethyl)ethanamide Openeye Name: 2-[[2-(4-bromo-2,5-dimethyl-phenyl)sulfanylacetyl]amino]-N-(2-furylmethyl)acetamide CAS Name: 2-[[2-[(4-bromo-2,5-dimethylphenyl)thio]-1-oxoethyl]amino]-N-(2-furanylmethyl)acetamide IUPAC Name: 2-[[2-(4-bromo-2,5-dimethylphenyl)sulfanylacetyl]amino]-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-[[2-[(4-bromo-2,5-dimethyl-phenyl)thio]acetyl]amino]-N-(2-furfuryl)acetamide Formula: C17H19BrN2O3S MolecularWeight: 411.31336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)NCC(=O)NCC2=CC=CO2

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)NCC(=O)NCC2=CC=CO2

InChI

InChI=1S/C17H19BrN2O3S/c1-11-7-15(12(2)6-14(11)18)24-10-17(22)20-9-16(21)19-8-13-4-3-5-23-13/h3-7H,8-10H2,1-2H3,(H,19,21)(H,20,22)