methyl 3-(4-azanyl-2,5-dimethyl-pyrazol-3-yl)sulfanylpropanoate

Systemtic Name: methyl 3-(4-azanyl-2,5-dimethyl-pyrazol-3-yl)sulfanylpropanoate Openeye Name: methyl 3-(4-amino-2,5-dimethyl-pyrazol-3-yl)sulfanylpropanoate CAS Name: 3-[(4-amino-2,5-dimethyl-3-pyrazolyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-(4-amino-2,5-dimethylpyrazol-3-yl)sulfanylpropanoate Traditional Name: 3-[(4-amino-2,5-dimethyl-pyrazol-3-yl)thio]propionic acid methyl ester Formula: C9H15N3O2S MolecularWeight: 229.2993

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1N)SCCC(=O)OC)C

Isomeric SMILES

CC1=NN(C(=C1N)SCCC(=O)OC)C

InChI

InChI=1S/C9H15N3O2S/c1-6-8(10)9(12(2)11-6)15-5-4-7(13)14-3/h4-5,10H2,1-3H3