ethyl (2R)-2-[(4-iodanyl-1-methyl-pyrazol-3-yl)carbonylamino]-3-sulfanyl-propanoate

Systemtic Name: ethyl (2R)-2-[(4-iodanyl-1-methyl-pyrazol-3-yl)carbonylamino]-3-sulfanyl-propanoate Openeye Name: ethyl (2R)-2-[(4-iodo-1-methyl-pyrazole-3-carbonyl)amino]-3-sulfanyl-propanoate CAS Name: (2R)-2-[[(4-iodo-1-methyl-3-pyrazolyl)-oxomethyl]amino]-3-mercaptopropanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-[(4-iodo-1-methylpyrazole-3-carbonyl)amino]-3-sulfanylpropanoate Traditional Name: (2R)-2-[(4-iodo-1-methyl-pyrazole-3-carbonyl)amino]-3-mercapto-propionic acid ethyl ester Formula: C10H14IN3O3S MolecularWeight: 383.20593

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CS)NC(=O)C1=NN(C=C1I)C

Isomeric SMILES

CCOC(=O)[C@H](CS)NC(=O)C1=NN(C=C1I)C

InChI

InChI=1S/C10H14IN3O3S/c1-3-17-10(16)7(5-18)12-9(15)8-6(11)4-14(2)13-8/h4,7,18H,3,5H2,1-2H3,(H,12,15)/t7-/m0/s1