[3-acetyloxy-4-[[3-(4-aminophenyl)sulfanyl-3-oxidanylidene-propyl]amino]-2,2-dimethyl-4-oxidanylidene-butyl] ethanoate; 3-[(2,4-diacetyloxy-3,3-dimethyl-butanoyl)amino]propanoic acid

Systemtic Name: [3-acetyloxy-4-[[3-(4-aminophenyl)sulfanyl-3-oxidanylidene-propyl]amino]-2,2-dimethyl-4-oxidanylidene-butyl] ethanoate; 3-[(2,4-diacetyloxy-3,3-dimethyl-butanoyl)amino]propanoic acid Openeye Name: [3-acetoxy-4-[[3-(4-aminophenyl)sulfanyl-3-oxo-propyl]amino]-2,2-dimethyl-4-oxo-butyl] acetate; 3-[(2,4-diacetoxy-3,3-dimethyl-butanoyl)amino]propanoic acid CAS Name: acetic acid [3-acetyloxy-4-[[3-[(4-aminophenyl)thio]-3-oxopropyl]amino]-2,2-dimethyl-4-oxobutyl] ester; 3-[(2,4-diacetyloxy-3,3-dimethyl-1-oxobutyl)amino]propanoic acid IUPAC Name: [3-acetyloxy-4-[[3-(4-aminophenyl)sulfanyl-3-oxopropyl]amino]-2,2-dimethyl-4-oxobutyl] acetate; 3-[(2,4-diacetyloxy-3,3-dimethylbutanoyl)amino]propanoic acid Traditional Name: acetic acid [3-acetoxy-4-[[3-[(4-aminophenyl)thio]-3-keto-propyl]amino]-4-keto-2,2-dimethyl-butyl] ester; 3-[(2,4-diacetoxy-3,3-dimethyl-butanoyl)amino]propionic acid Formula: C32H47N3O13S MolecularWeight: 713.79288

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC(C)(C)C(C(=O)NCCC(=O)O)OC(=O)C.CC(=O)OCC(C)(C)C(C(=O)NCCC(=O)SC1=CC=C(C=C1)N)OC(=O)C

Isomeric SMILES

CC(=O)OCC(C)(C)C(C(=O)NCCC(=O)O)OC(=O)C.CC(=O)OCC(C)(C)C(C(=O)NCCC(=O)SC1=CC=C(C=C1)N)OC(=O)C

InChI

InChI=1S/C19H26N2O6S.C13H21NO7/c1-12(22)26-11-19(3,4)17(27-13(2)23)18(25)21-10-9-16(24)28-15-7-5-14(20)6-8-15;1-8(15)20-7-13(3,4)11(21-9(2)16)12(19)14-6-5-10(17)18/h5-8,17H,9-11,20H2,1-4H3,(H,21,25);11H,5-7H2,1-4H3,(H,14,19)(H,17,18)