4-[2-[[(2R)-3-ethyl-2-morpholin-4-yl-pentyl]amino]-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[2-[[(2R)-3-ethyl-2-morpholin-4-yl-pentyl]amino]-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-[2-[[(2R)-3-ethyl-2-morpholino-pentyl]amino]-2-oxo-ethyl]-5-(2-thienyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[2-[[(2R)-3-ethyl-2-(4-morpholinyl)pentyl]amino]-2-oxoethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[2-[[(2R)-3-ethyl-2-morpholin-4-ylpentyl]amino]-2-oxoethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-[2-[[(2R)-3-ethyl-2-morpholino-pentyl]amino]-2-keto-ethyl]-5-(2-thienyl)-1,2,4-triazole-3-thiolate Formula: C19H28N5O2S2- MolecularWeight: 422.58792

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(CNC(=O)CN1C(=NN=C1[S-])C2=CC=CS2)N3CCOCC3

Isomeric SMILES

CCC(CC)[C@H](CNC(=O)CN1C(=NN=C1[S-])C2=CC=CS2)N3CCOCC3

InChI

InChI=1S/C19H29N5O2S2/c1-3-14(4-2)15(23-7-9-26-10-8-23)12-20-17(25)13-24-18(21-22-19(24)27)16-6-5-11-28-16/h5-6,11,14-15H,3-4,7-10,12-13H2,1-2H3,(H,20,25)(H,22,27)/p-1/t15-/m0/s1