ethyl 2-[2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[(5-methyl-2-phenyl-3-pyrazolyl)amino]-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(5-methyl-2-phenylpyrazol-3-yl)amino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-[(5-methyl-2-phenyl-pyrazol-3-yl)amino]ethyl]thio]acetic acid ethyl ester Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)NC1=CC(=NN1C2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)CSCC(=O)NC1=CC(=NN1C2=CC=CC=C2)C

InChI

InChI=1S/C16H19N3O3S/c1-3-22-16(21)11-23-10-15(20)17-14-9-12(2)18-19(14)13-7-5-4-6-8-13/h4-9H,3,10-11H2,1-2H3,(H,17,20)