5-[[2-[(4-tert-butylphenyl)carbonylamino]-1,3-thiazol-5-yl]sulfanyl]-2,4-dimethyl-benzoic acid

Systemtic Name: 5-[[2-[(4-tert-butylphenyl)carbonylamino]-1,3-thiazol-5-yl]sulfanyl]-2,4-dimethyl-benzoic acid Openeye Name: 5-[2-[(4-tert-butylbenzoyl)amino]thiazol-5-yl]sulfanyl-2,4-dimethyl-benzoic acid CAS Name: 5-[[2-[[(4-tert-butylphenyl)-oxomethyl]amino]-5-thiazolyl]thio]-2,4-dimethylbenzoic acid IUPAC Name: 5-[[2-[(4-tert-butylbenzoyl)amino]-1,3-thiazol-5-yl]sulfanyl]-2,4-dimethylbenzoic acid Traditional Name: 5-[[2-[(4-tert-butylbenzoyl)amino]thiazol-5-yl]thio]-2,4-dimethyl-benzoic acid Formula: C23H24N2O3S2 MolecularWeight: 440.57826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)O)SC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)O)SC2=CN=C(S2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)C

InChI

InChI=1S/C23H24N2O3S2/c1-13-10-14(2)18(11-17(13)21(27)28)29-19-12-24-22(30-19)25-20(26)15-6-8-16(9-7-15)23(3,4)5/h6-12H,1-5H3,(H,27,28)(H,24,25,26)