4-[(3R)-3-(5-methylfuran-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoate

Systemtic Name: 4-[(3R)-3-(5-methylfuran-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-4-oxidanylidene-butanoate Openeye Name: 4-[(3R)-3-(5-methyl-2-furyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]-4-oxo-butanoate CAS Name: 4-[(3R)-3-(5-methyl-2-furanyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-4-oxobutanoate IUPAC Name: 4-[(3R)-3-(5-methylfuran-2-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-4-oxobutanoate Traditional Name: 4-keto-4-[(5R)-5-(5-methyl-2-furyl)-3-(2-thienyl)-2-pyrazolin-1-yl]butyrate Formula: C16H15N2O4S- MolecularWeight: 331.3663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2CC(=NN2C(=O)CCC(=O)[O-])C3=CC=CS3

Isomeric SMILES

CC1=CC=C(O1)[C@H]2CC(=NN2C(=O)CCC(=O)[O-])C3=CC=CS3

InChI

InChI=1S/C16H16N2O4S/c1-10-4-5-13(22-10)12-9-11(14-3-2-8-23-14)17-18(12)15(19)6-7-16(20)21/h2-5,8,12H,6-7,9H2,1H3,(H,20,21)/p-1/t12-/m1/s1