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

Systemtic Name: ethyl 3-[(1-propyl-3-thiomorpholin-4-ylcarbonyl-4,5,6,7-tetrahydroindazol-5-yl)amino]propanoate Openeye Name: ethyl 3-[[1-propyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]amino]propanoate CAS Name: 3-[[3-[oxo(thiomorpholin-4-yl)methyl]-1-propyl-4,5,6,7-tetrahydroindazol-5-yl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[1-propyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]amino]propanoate Traditional Name: 3-[[1-propyl-3-(thiomorpholine-4-carbonyl)-4,5,6,7-tetrahydroindazol-5-yl]amino]propionic acid ethyl ester Formula: C20H32N4O3S MolecularWeight: 408.55808

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(CC(CC2)NCCC(=O)OCC)C(=N1)C(=O)N3CCSCC3

Isomeric SMILES

CCCN1C2=C(CC(CC2)NCCC(=O)OCC)C(=N1)C(=O)N3CCSCC3

InChI

InChI=1S/C20H32N4O3S/c1-3-9-24-17-6-5-15(21-8-7-18(25)27-4-2)14-16(17)19(22-24)20(26)23-10-12-28-13-11-23/h15,21H,3-14H2,1-2H3