4-[2-[2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)ethanoylcarbamothioyl]hydrazinyl]-N-(2,4-dimethylphenyl)-4-oxidanylidene-butanamide

Systemtic Name: 4-[2-[2-(4-bromanyl-5-methyl-2-propan-2-yl-phenoxy)ethanoylcarbamothioyl]hydrazinyl]-N-(2,4-dimethylphenyl)-4-oxidanylidene-butanamide Openeye Name: 4-[2-[[2-(4-bromo-2-isopropyl-5-methyl-phenoxy)acetyl]carbamothioyl]hydrazino]-N-(2,4-dimethylphenyl)-4-oxo-butanamide CAS Name: 4-[[[[2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)-1-oxoethyl]amino]-sulfanylidenemethyl]hydrazo]-N-(2,4-dimethylphenyl)-4-oxobutanamide IUPAC Name: 4-[2-[[2-(4-bromo-5-methyl-2-propan-2-ylphenoxy)acetyl]carbamothioyl]hydrazinyl]-N-(2,4-dimethylphenyl)-4-oxobutanamide Traditional Name: 4-[N'-[[2-(4-bromo-2-isopropyl-5-methyl-phenoxy)acetyl]thiocarbamoyl]hydrazino]-N-(2,4-dimethylphenyl)-4-keto-butyramide Formula: C25H31BrN4O4S MolecularWeight: 563.50704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCC(=O)NNC(=S)NC(=O)COC2=C(C=C(C(=C2)C)Br)C(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCC(=O)NNC(=S)NC(=O)COC2=C(C=C(C(=C2)C)Br)C(C)C)C

InChI

InChI=1S/C25H31BrN4O4S/c1-14(2)18-12-19(26)16(4)11-21(18)34-13-24(33)28-25(35)30-29-23(32)9-8-22(31)27-20-7-6-15(3)10-17(20)5/h6-7,10-12,14H,8-9,13H2,1-5H3,(H,27,31)(H,29,32)(H2,28,30,33,35)