methyl 5-azanyl-1-cyclopentyl-3-methylsulfanyl-pyrazole-4-carboxylate

Systemtic Name: methyl 5-azanyl-1-cyclopentyl-3-methylsulfanyl-pyrazole-4-carboxylate Openeye Name: methyl 5-amino-1-cyclopentyl-3-methylsulfanyl-pyrazole-4-carboxylate CAS Name: 5-amino-1-cyclopentyl-3-(methylthio)-4-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-amino-1-cyclopentyl-3-methylsulfanylpyrazole-4-carboxylate Traditional Name: 5-amino-1-cyclopentyl-3-(methylthio)pyrazole-4-carboxylic acid methyl ester Formula: C11H17N3O2S MolecularWeight: 255.33658

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=C1SC)C2CCCC2)N

Isomeric SMILES

COC(=O)C1=C(N(N=C1SC)C2CCCC2)N

InChI

InChI=1S/C11H17N3O2S/c1-16-11(15)8-9(12)14(13-10(8)17-2)7-5-3-4-6-7/h7H,3-6,12H2,1-2H3