4-[(4-acetamidophenyl)amino]-2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(4-acetamidophenyl)amino]-2-[[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(4-acetamidoanilino)-4-oxo-2-[[1-(p-tolylsulfonyl)pyrrolidine-2-carbonyl]amino]butanoic acid CAS Name: 4-(4-acetamidoanilino)-2-[[[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-(4-acetamidoanilino)-2-[[1-(4-methylphenyl)sulfonylpyrrolidine-2-carbonyl]amino]-4-oxobutanoic acid Traditional Name: 4-(4-acetamidoanilino)-4-keto-2-[(1-tosylprolyl)amino]butyric acid Formula: C24H28N4O7S MolecularWeight: 516.56672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC(CC(=O)NC3=CC=C(C=C3)NC(=O)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC(CC(=O)NC3=CC=C(C=C3)NC(=O)C)C(=O)O

InChI

InChI=1S/C24H28N4O7S/c1-15-5-11-19(12-6-15)36(34,35)28-13-3-4-21(28)23(31)27-20(24(32)33)14-22(30)26-18-9-7-17(8-10-18)25-16(2)29/h5-12,20-21H,3-4,13-14H2,1-2H3,(H,25,29)(H,26,30)(H,27,31)(H,32,33)