2-[2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(3,3-dimethyl-2-oxidanylidene-butyl)benzamide

Systemtic Name: 2-[2-[(3-acetamidophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-N-(3,3-dimethyl-2-oxidanylidene-butyl)benzamide Openeye Name: 2-[2-(3-acetamidoanilino)-2-oxo-ethyl]sulfanyl-N-(3,3-dimethyl-2-oxo-butyl)benzamide CAS Name: 2-[[2-(3-acetamidoanilino)-2-oxoethyl]thio]-N-(3,3-dimethyl-2-oxobutyl)benzamide IUPAC Name: 2-[2-(3-acetamidoanilino)-2-oxoethyl]sulfanyl-N-(3,3-dimethyl-2-oxobutyl)benzamide Traditional Name: 2-[[2-(3-acetamidoanilino)-2-keto-ethyl]thio]-N-(2-keto-3,3-dimethyl-butyl)benzamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=CC=CC=C2C(=O)NCC(=O)C(C)(C)C

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)CSC2=CC=CC=C2C(=O)NCC(=O)C(C)(C)C

InChI

InChI=1S/C23H27N3O4S/c1-15(27)25-16-8-7-9-17(12-16)26-21(29)14-31-19-11-6-5-10-18(19)22(30)24-13-20(28)23(2,3)4/h5-12H,13-14H2,1-4H3,(H,24,30)(H,25,27)(H,26,29)