(1R,2R)-2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]cyclohexane-1-carboxylate

Systemtic Name: (1R,2R)-2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]cyclohexane-1-carboxylate Openeye Name: (1R,2R)-2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]cyclohexanecarboxylate CAS Name: (1R,2R)-2-[[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]amino]-oxomethyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2R)-2-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)carbamoyl]cyclohexane-1-carboxylate Traditional Name: (1R,2R)-2-[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]carbamoyl]cyclohexanecarboxylate Formula: C12H16N3O3S2- MolecularWeight: 314.40374

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)C2CCCCC2C(=O)[O-]

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)[C@@H]2CCCC[C@H]2C(=O)[O-]

InChI

InChI=1S/C12H17N3O3S2/c1-2-19-12-15-14-11(20-12)13-9(16)7-5-3-4-6-8(7)10(17)18/h7-8H,2-6H2,1H3,(H,17,18)(H,13,14,16)/p-1/t7-,8-/m1/s1