2-[2-azanyl-3-(2,6-dimethyl-4-oxidanyl-phenyl)propanoyl]-1-oxidanylidene-N-(3-phenylpropyl)thiolane-3-carbohydrazide

Systemtic Name: 2-[2-azanyl-3-(2,6-dimethyl-4-oxidanyl-phenyl)propanoyl]-1-oxidanylidene-N-(3-phenylpropyl)thiolane-3-carbohydrazide Openeye Name: 2-[2-amino-3-(4-hydroxy-2,6-dimethyl-phenyl)propanoyl]-1-oxo-N-(3-phenylpropyl)thiolane-3-carbohydrazide CAS Name: 2-[2-amino-3-(4-hydroxy-2,6-dimethylphenyl)-1-oxopropyl]-1-oxo-N-(3-phenylpropyl)-3-thiolanecarbohydrazide IUPAC Name: 2-[2-amino-3-(4-hydroxy-2,6-dimethylphenyl)propanoyl]-1-oxo-N-(3-phenylpropyl)thiolane-3-carbohydrazide Traditional Name: 2-[2-amino-3-(4-hydroxy-2,6-dimethyl-phenyl)propanoyl]-1-keto-N-(3-phenylpropyl)thiolane-3-carbohydrazide Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CC(C(=O)C2C(CCS2=O)C(=O)N(CCCC3=CC=CC=C3)N)N)C)O

Isomeric SMILES

CC1=CC(=CC(=C1CC(C(=O)C2C(CCS2=O)C(=O)N(CCCC3=CC=CC=C3)N)N)C)O

InChI

InChI=1S/C25H33N3O4S/c1-16-13-19(29)14-17(2)21(16)15-22(26)23(30)24-20(10-12-33(24)32)25(31)28(27)11-6-9-18-7-4-3-5-8-18/h3-5,7-8,13-14,20,22,24,29H,6,9-12,15,26-27H2,1-2H3