4-methyl-2-[[4-(1,2,3-thiadiazol-4-yl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-methyl-2-[[4-(1,2,3-thiadiazol-4-yl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 4-methyl-2-[[4-(thiadiazol-4-yl)phenyl]carbamoyl]cyclohexanecarboxylic acid CAS Name: 4-methyl-2-[oxo-[4-(4-thiadiazolyl)anilino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-methyl-2-[[4-(thiadiazol-4-yl)phenyl]carbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 4-methyl-2-[[4-(thiadiazol-4-yl)phenyl]carbamoyl]cyclohexanecarboxylic acid Formula: C17H19N3O3S MolecularWeight: 345.41606

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)C(=O)NC2=CC=C(C=C2)C3=CSN=N3)C(=O)O

Isomeric SMILES

CC1CCC(C(C1)C(=O)NC2=CC=C(C=C2)C3=CSN=N3)C(=O)O

InChI

InChI=1S/C17H19N3O3S/c1-10-2-7-13(17(22)23)14(8-10)16(21)18-12-5-3-11(4-6-12)15-9-24-20-19-15/h3-6,9-10,13-14H,2,7-8H2,1H3,(H,18,21)(H,22,23)