ethyl (2R)-2-[(1,5-dimethylpyrazol-4-yl)carbonylamino]-3-sulfanyl-propanoate

Systemtic Name: ethyl (2R)-2-[(1,5-dimethylpyrazol-4-yl)carbonylamino]-3-sulfanyl-propanoate Openeye Name: ethyl (2R)-2-[(1,5-dimethylpyrazole-4-carbonyl)amino]-3-sulfanyl-propanoate CAS Name: (2R)-2-[[(1,5-dimethyl-4-pyrazolyl)-oxomethyl]amino]-3-mercaptopropanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-[(1,5-dimethylpyrazole-4-carbonyl)amino]-3-sulfanylpropanoate Traditional Name: (2R)-2-[(1,5-dimethylpyrazole-4-carbonyl)amino]-3-mercapto-propionic acid ethyl ester Formula: C11H17N3O3S MolecularWeight: 271.33598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CS)NC(=O)C1=C(N(N=C1)C)C

Isomeric SMILES

CCOC(=O)[C@H](CS)NC(=O)C1=C(N(N=C1)C)C

InChI

InChI=1S/C11H17N3O3S/c1-4-17-11(16)9(6-18)13-10(15)8-5-12-14(3)7(8)2/h5,9,18H,4,6H2,1-3H3,(H,13,15)/t9-/m0/s1