ethyl 2-[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)amino]-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)amino]-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[(3,5-dimethyl-1-phenylpyrazol-4-yl)amino]-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)amino]-2-keto-ethyl]thio]acetic acid ethyl ester Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)NC1=C(N(N=C1C)C2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)CSCC(=O)NC1=C(N(N=C1C)C2=CC=CC=C2)C

InChI

InChI=1S/C17H21N3O3S/c1-4-23-16(22)11-24-10-15(21)18-17-12(2)19-20(13(17)3)14-8-6-5-7-9-14/h5-9H,4,10-11H2,1-3H3,(H,18,21)