ethyl (2R)-2-[[5-(pyrazol-1-ylmethyl)furan-2-yl]carbonylamino]-3-sulfanyl-propanoate

Systemtic Name: ethyl (2R)-2-[[5-(pyrazol-1-ylmethyl)furan-2-yl]carbonylamino]-3-sulfanyl-propanoate Openeye Name: ethyl (2R)-2-[[5-(pyrazol-1-ylmethyl)furan-2-carbonyl]amino]-3-sulfanyl-propanoate CAS Name: (2R)-3-mercapto-2-[[oxo-[5-(1-pyrazolylmethyl)-2-furanyl]methyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (2R)-2-[[5-(pyrazol-1-ylmethyl)furan-2-carbonyl]amino]-3-sulfanylpropanoate Traditional Name: (2R)-3-mercapto-2-[[5-(pyrazol-1-ylmethyl)-2-furoyl]amino]propionic acid ethyl ester Formula: C14H17N3O4S MolecularWeight: 323.36748

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CS)NC(=O)C1=CC=C(O1)CN2C=CC=N2

Isomeric SMILES

CCOC(=O)[C@H](CS)NC(=O)C1=CC=C(O1)CN2C=CC=N2

InChI

InChI=1S/C14H17N3O4S/c1-2-20-14(19)11(9-22)16-13(18)12-5-4-10(21-12)8-17-7-3-6-15-17/h3-7,11,22H,2,8-9H2,1H3,(H,16,18)/t11-/m0/s1