(1S,6R)-6-[[(5-ethylthiophen-3-yl)carbonylamino]carbamoyl]cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6R)-6-[[(5-ethylthiophen-3-yl)carbonylamino]carbamoyl]cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6R)-6-[[(5-ethylthiophene-3-carbonyl)amino]carbamoyl]cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-6-[[[(5-ethyl-3-thiophenyl)-oxomethyl]hydrazo]-oxomethyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6R)-6-[[(5-ethylthiophene-3-carbonyl)amino]carbamoyl]cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-6-[[(5-ethylthiophene-3-carbonyl)amino]carbamoyl]cyclohex-3-ene-1-carboxylate Formula: C15H17N2O4S- MolecularWeight: 321.37148

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CS1)C(=O)NNC(=O)C2CC=CCC2C(=O)[O-]

Isomeric SMILES

CCC1=CC(=CS1)C(=O)NNC(=O)[C@@H]2CC=CC[C@@H]2C(=O)[O-]

InChI

InChI=1S/C15H18N2O4S/c1-2-10-7-9(8-22-10)13(18)16-17-14(19)11-5-3-4-6-12(11)15(20)21/h3-4,7-8,11-12H,2,5-6H2,1H3,(H,16,18)(H,17,19)(H,20,21)/p-1/t11-,12+/m1/s1