2-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoylamino]-4,5-dimethoxy-N,N-dimethyl-benzamide

Systemtic Name: 2-[2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanylethanoylamino]-4,5-dimethoxy-N,N-dimethyl-benzamide Openeye Name: 2-[[2-(4-bromo-2,5-dimethyl-phenyl)sulfanylacetyl]amino]-4,5-dimethoxy-N,N-dimethyl-benzamide CAS Name: 2-[[2-[(4-bromo-2,5-dimethylphenyl)thio]-1-oxoethyl]amino]-4,5-dimethoxy-N,N-dimethylbenzamide IUPAC Name: 2-[[2-(4-bromo-2,5-dimethylphenyl)sulfanylacetyl]amino]-4,5-dimethoxy-N,N-dimethylbenzamide Traditional Name: 2-[[2-[(4-bromo-2,5-dimethyl-phenyl)thio]acetyl]amino]-4,5-dimethoxy-N,N-dimethyl-benzamide Formula: C21H25BrN2O4S MolecularWeight: 481.4032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)NC2=CC(=C(C=C2C(=O)N(C)C)OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)NC2=CC(=C(C=C2C(=O)N(C)C)OC)OC

InChI

InChI=1S/C21H25BrN2O4S/c1-12-8-19(13(2)7-15(12)22)29-11-20(25)23-16-10-18(28-6)17(27-5)9-14(16)21(26)24(3)4/h7-10H,11H2,1-6H3,(H,23,25)