4-[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(2,4,6-trimethylphenyl)butanamide

Systemtic Name: 4-[2-[(2-bromanyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(2,4,6-trimethylphenyl)butanamide Openeye Name: 4-[2-(2-bromo-4-methyl-anilino)-2-oxo-ethyl]sulfanyl-N-(2,4,6-trimethylphenyl)butanamide CAS Name: 4-[[2-(2-bromo-4-methylanilino)-2-oxoethyl]thio]-N-(2,4,6-trimethylphenyl)butanamide IUPAC Name: 4-[2-(2-bromo-4-methylanilino)-2-oxoethyl]sulfanyl-N-(2,4,6-trimethylphenyl)butanamide Traditional Name: 4-[[2-(2-bromo-4-methyl-anilino)-2-keto-ethyl]thio]-N-mesityl-butyramide Formula: C22H27BrN2O2S MolecularWeight: 463.43098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSCCCC(=O)NC2=C(C=C(C=C2C)C)C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSCCCC(=O)NC2=C(C=C(C=C2C)C)C)Br

InChI

InChI=1S/C22H27BrN2O2S/c1-14-7-8-19(18(23)12-14)24-21(27)13-28-9-5-6-20(26)25-22-16(3)10-15(2)11-17(22)4/h7-8,10-12H,5-6,9,13H2,1-4H3,(H,24,27)(H,25,26)