ethyl (2R)-2-[(1-ethylpyrazol-4-yl)carbonylamino]-3-sulfanyl-propanoate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C(=O)NC(CS)C(=O)OCC

Isomeric SMILES

CCN1C=C(C=N1)C(=O)N[C@@H](CS)C(=O)OCC

InChI

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