methyl (2R)-4-[(3-cyclopropyl-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[(3-cyclopropyl-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[(3-cyclopropyl-4-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[(3-cyclopropyl-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[(3-cyclopropyl-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[(3-cyclopropyl-4-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C13H20N4O2S2 MolecularWeight: 328.4535

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)CN2CCSC(C2)C(=O)OC)C3CC3

Isomeric SMILES

CN1C(=NN(C1=S)CN2CCS[C@H](C2)C(=O)OC)C3CC3

InChI

InChI=1S/C13H20N4O2S2/c1-15-11(9-3-4-9)14-17(13(15)20)8-16-5-6-21-10(7-16)12(18)19-2/h9-10H,3-8H2,1-2H3/t10-/m1/s1