ethyl 3-azanyl-1-(6-thiomorpholin-4-ylpyridazin-3-yl)pyrazole-4-carboxylate

Systemtic Name: ethyl 3-azanyl-1-(6-thiomorpholin-4-ylpyridazin-3-yl)pyrazole-4-carboxylate Openeye Name: ethyl 3-amino-1-(6-thiomorpholinopyridazin-3-yl)pyrazole-4-carboxylate CAS Name: 3-amino-1-(6-thiomorpholin-4-yl-3-pyridazinyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-amino-1-(6-thiomorpholin-4-ylpyridazin-3-yl)pyrazole-4-carboxylate Traditional Name: 3-amino-1-(6-thiomorpholinopyridazin-3-yl)pyrazole-4-carboxylic acid ethyl ester Formula: C14H18N6O2S MolecularWeight: 334.39672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(N=C1N)C2=NN=C(C=C2)N3CCSCC3

Isomeric SMILES

CCOC(=O)C1=CN(N=C1N)C2=NN=C(C=C2)N3CCSCC3

InChI

InChI=1S/C14H18N6O2S/c1-2-22-14(21)10-9-20(18-13(10)15)12-4-3-11(16-17-12)19-5-7-23-8-6-19/h3-4,9H,2,5-8H2,1H3,(H2,15,18)