4-[2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(2,6-dimethylphenyl)butanamide

Systemtic Name: 4-[2-[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(2,6-dimethylphenyl)butanamide Openeye Name: 4-[2-[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]-2-oxo-ethyl]sulfanyl-N-(2,6-dimethylphenyl)butanamide CAS Name: 4-[[2-[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]-2-oxoethyl]thio]-N-(2,6-dimethylphenyl)butanamide IUPAC Name: 4-[2-[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]-2-oxoethyl]sulfanyl-N-(2,6-dimethylphenyl)butanamide Traditional Name: N-(2,6-dimethylphenyl)-4-[[2-keto-2-[(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)amino]ethyl]thio]butyramide Formula: C25H30N4O3S MolecularWeight: 466.5957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCCSCC(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCCSCC(=O)NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C

InChI

InChI=1S/C25H30N4O3S/c1-17-10-8-11-18(2)23(17)26-21(30)14-9-15-33-16-22(31)27-24-19(3)28(4)29(25(24)32)20-12-6-5-7-13-20/h5-8,10-13H,9,14-16H2,1-4H3,(H,26,30)(H,27,31)