ethyl 5-azanyl-3-methylsulfanyl-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-3-methylsulfanyl-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-3-methylsulfanyl-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-amino-3-(methylthio)-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-methylsulfanyl-1-phenylpyrazole-4-carboxylate Traditional Name: 5-amino-3-(methylthio)-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1SC)C2=CC=CC=C2)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1SC)C2=CC=CC=C2)N

InChI

InChI=1S/C13H15N3O2S/c1-3-18-13(17)10-11(14)16(15-12(10)19-2)9-7-5-4-6-8-9/h4-8H,3,14H2,1-2H3