2-[[5-(4-chlorophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[[5-(4-chlorophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]cyclohexane-1-carboxylic acid Openeye Name: 2-[[5-(4-chlorophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]cyclohexanecarboxylic acid CAS Name: 2-[[5-(4-chlorophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[[5-(4-chlorophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]cyclohexane-1-carboxylic acid Traditional Name: 2-[[5-(4-chlorophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]cyclohexanecarboxylic acid Formula: C16H18ClN3O2S MolecularWeight: 351.85102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2CCCCC2C(=O)O)SC(=N1)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C(=NC2CCCCC2C(=O)O)SC(=N1)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H18ClN3O2S/c1-20-16(18-13-5-3-2-4-12(13)15(21)22)23-14(19-20)10-6-8-11(17)9-7-10/h6-9,12-13H,2-5H2,1H3,(H,21,22)