(1S,6R)-6-[(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: (1S,6R)-6-[(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: (1S,6R)-6-[[5-(2-thienyl)-1,3,4-thiadiazol-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid CAS Name: (1S,6R)-6-[oxo-[(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)amino]methyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: (1S,6R)-6-[(5-thiophen-2-yl-1,3,4-thiadiazol-2-yl)carbamoyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: (1S,6R)-6-[[5-(2-thienyl)-1,3,4-thiadiazol-2-yl]carbamoyl]cyclohex-3-ene-1-carboxylic acid Formula: C14H13N3O3S2 MolecularWeight: 335.40132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(C1C(=O)NC2=NN=C(S2)C3=CC=CS3)C(=O)O

Isomeric SMILES

C1C=CC[C@@H]([C@@H]1C(=O)NC2=NN=C(S2)C3=CC=CS3)C(=O)O

InChI

InChI=1S/C14H13N3O3S2/c18-11(8-4-1-2-5-9(8)13(19)20)15-14-17-16-12(22-14)10-6-3-7-21-10/h1-3,6-9H,4-5H2,(H,19,20)(H,15,17,18)/t8-,9+/m1/s1