[2-[(5-cyclopropyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl] 2-phenylsulfanylpropanoate

Systemtic Name: [2-[(5-cyclopropyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl] 2-phenylsulfanylpropanoate Openeye Name: [2-[(5-cyclopropyl-2-phenyl-pyrazol-3-yl)amino]-2-oxo-ethyl] 2-phenylsulfanylpropanoate CAS Name: 2-(phenylthio)propanoic acid [2-[(5-cyclopropyl-2-phenyl-3-pyrazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-cyclopropyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl] 2-phenylsulfanylpropanoate Traditional Name: 2-(phenylthio)propionic acid [2-[(5-cyclopropyl-2-phenyl-pyrazol-3-yl)amino]-2-keto-ethyl] ester Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1=CC(=NN1C2=CC=CC=C2)C3CC3)SC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)OCC(=O)NC1=CC(=NN1C2=CC=CC=C2)C3CC3)SC4=CC=CC=C4

InChI

InChI=1S/C23H23N3O3S/c1-16(30-19-10-6-3-7-11-19)23(28)29-15-22(27)24-21-14-20(17-12-13-17)25-26(21)18-8-4-2-5-9-18/h2-11,14,16-17H,12-13,15H2,1H3,(H,24,27)