2-[1-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[1-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxidanylidene-ethyl]cyclohexyl]ethanoic acid Openeye Name: 2-[1-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxo-ethyl]cyclohexyl]acetic acid CAS Name: 2-[1-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl]cyclohexyl]acetic acid IUPAC Name: 2-[1-[2-(2,1,3-benzothiadiazol-4-ylamino)-2-oxoethyl]cyclohexyl]acetic acid Traditional Name: 2-[1-[2-keto-2-(piazthiol-4-ylamino)ethyl]cyclohexyl]acetic acid Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CC(=O)NC2=CC=CC3=NSN=C32)CC(=O)O

Isomeric SMILES

C1CCC(CC1)(CC(=O)NC2=CC=CC3=NSN=C32)CC(=O)O

InChI

InChI=1S/C16H19N3O3S/c20-13(9-16(10-14(21)22)7-2-1-3-8-16)17-11-5-4-6-12-15(11)19-23-18-12/h4-6H,1-3,7-10H2,(H,17,20)(H,21,22)