4-[2-[[(2S)-1-methoxypropan-2-yl]amino]-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[2-[[(2S)-1-methoxypropan-2-yl]amino]-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-[2-[[(1S)-2-methoxy-1-methyl-ethyl]amino]-2-oxo-ethyl]-5-(2-thienyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[2-[[(2S)-1-methoxypropan-2-yl]amino]-2-oxoethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[2-[[(2S)-1-methoxypropan-2-yl]amino]-2-oxoethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-[2-keto-2-[[(1S)-2-methoxy-1-methyl-ethyl]amino]ethyl]-5-(2-thienyl)-1,2,4-triazole-3-thiolate Formula: C12H15N4O2S2- MolecularWeight: 311.4031

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC(=O)CN1C(=NN=C1[S-])C2=CC=CS2

Isomeric SMILES

C[C@@H](COC)NC(=O)CN1C(=NN=C1[S-])C2=CC=CS2

InChI

InChI=1S/C12H16N4O2S2/c1-8(7-18-2)13-10(17)6-16-11(14-15-12(16)19)9-4-3-5-20-9/h3-5,8H,6-7H2,1-2H3,(H,13,17)(H,15,19)/p-1/t8-/m0/s1