2-[(2-ethyl-5-propan-2-yl-pyrazol-3-yl)carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(2-ethyl-5-propan-2-yl-pyrazol-3-yl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(2-ethyl-5-isopropyl-pyrazole-3-carbonyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(2-ethyl-5-propan-2-yl-3-pyrazolyl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(2-ethyl-5-propan-2-ylpyrazole-3-carbonyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(2-ethyl-5-isopropyl-pyrazole-3-carbonyl)amino]-4-(methylthio)butyric acid Formula: C14H23N3O3S MolecularWeight: 313.41572

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C(C)C)C(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CCN1C(=CC(=N1)C(C)C)C(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C14H23N3O3S/c1-5-17-12(8-11(16-17)9(2)3)13(18)15-10(14(19)20)6-7-21-4/h8-10H,5-7H2,1-4H3,(H,15,18)(H,19,20)