butyl 4-[2-[(4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-[(4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-(4-tert-butylthiazol-2-yl)sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[(4-tert-butyl-2-thiazolyl)thio]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[(4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 4-[[2-[(4-tert-butylthiazol-2-yl)thio]acetyl]amino]benzoic acid butyl ester Formula: C20H26N2O3S2 MolecularWeight: 406.56204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=CS2)C(C)(C)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=CS2)C(C)(C)C

InChI

InChI=1S/C20H26N2O3S2/c1-5-6-11-25-18(24)14-7-9-15(10-8-14)21-17(23)13-27-19-22-16(12-26-19)20(2,3)4/h7-10,12H,5-6,11,13H2,1-4H3,(H,21,23)