5-[2-[4-(cyclohexylcarbonylamino)phenyl]sulfanylethanoylamino]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[2-[4-(cyclohexylcarbonylamino)phenyl]sulfanylethanoylamino]-2-oxidanyl-benzoic acid Openeye Name: 5-[[2-[4-(cyclohexanecarbonylamino)phenyl]sulfanylacetyl]amino]-2-hydroxy-benzoic acid CAS Name: 5-[[2-[[4-[[cyclohexyl(oxo)methyl]amino]phenyl]thio]-1-oxoethyl]amino]-2-hydroxybenzoic acid IUPAC Name: 5-[[2-[4-(cyclohexanecarbonylamino)phenyl]sulfanylacetyl]amino]-2-hydroxybenzoic acid Traditional Name: 5-[[2-[[4-(cyclohexanecarbonylamino)phenyl]thio]acetyl]amino]-2-hydroxy-benzoic acid Formula: C22H24N2O5S MolecularWeight: 428.50136

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=CC(=C(C=C3)O)C(=O)O

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=CC(=C(C=C3)O)C(=O)O

InChI

InChI=1S/C22H24N2O5S/c25-19-11-8-16(12-18(19)22(28)29)23-20(26)13-30-17-9-6-15(7-10-17)24-21(27)14-4-2-1-3-5-14/h6-12,14,25H,1-5,13H2,(H,23,26)(H,24,27)(H,28,29)