2-[5-(4-chlorophenyl)-2-cyclohexylimino-1,3,4-thiadiazol-3-yl]ethanoic acid

Systemtic Name: 2-[5-(4-chlorophenyl)-2-cyclohexylimino-1,3,4-thiadiazol-3-yl]ethanoic acid Openeye Name: 2-[5-(4-chlorophenyl)-2-cyclohexylimino-1,3,4-thiadiazol-3-yl]acetic acid CAS Name: 2-[5-(4-chlorophenyl)-2-cyclohexylimino-1,3,4-thiadiazol-3-yl]acetic acid IUPAC Name: 2-[5-(4-chlorophenyl)-2-cyclohexylimino-1,3,4-thiadiazol-3-yl]acetic acid Traditional Name: 2-[5-(4-chlorophenyl)-2-cyclohexylimino-1,3,4-thiadiazol-3-yl]acetic acid Formula: C16H18ClN3O2S MolecularWeight: 351.85102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N=C2N(N=C(S2)C3=CC=C(C=C3)Cl)CC(=O)O

Isomeric SMILES

C1CCC(CC1)N=C2N(N=C(S2)C3=CC=C(C=C3)Cl)CC(=O)O

InChI

InChI=1S/C16H18ClN3O2S/c17-12-8-6-11(7-9-12)15-19-20(10-14(21)22)16(23-15)18-13-4-2-1-3-5-13/h6-9,13H,1-5,10H2,(H,21,22)