ethyl 3-[(1-ethyl-3-thiomorpholin-4-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl)amino]propanoate

Systemtic Name: ethyl 3-[(1-ethyl-3-thiomorpholin-4-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl)amino]propanoate Openeye Name: ethyl 3-[[1-ethyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]amino]propanoate CAS Name: 3-[[1-ethyl-3-[oxo(thiomorpholin-4-yl)methyl]-4,5,6,7-tetrahydroindazol-5-yl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[1-ethyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]amino]propanoate Traditional Name: 3-[[1-ethyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]amino]propionic acid ethyl ester Formula: C19H30N4O3S MolecularWeight: 394.5315

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(CC(CC2)NCCC(=O)OCC)C(=N1)C(=O)N3CCSCC3

Isomeric SMILES

CCN1C2=C(CC(CC2)NCCC(=O)OCC)C(=N1)C(=O)N3CCSCC3

InChI

InChI=1S/C19H30N4O3S/c1-3-23-16-6-5-14(20-8-7-17(24)26-4-2)13-15(16)18(21-23)19(25)22-9-11-27-12-10-22/h14,20H,3-13H2,1-2H3