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

Systemtic Name: methyl 4-[2-[(4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C17H20N2O3S2 MolecularWeight: 364.4823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)SCC(=O)NC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)SCC(=O)NC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C17H20N2O3S2/c1-17(2,3)13-9-23-16(19-13)24-10-14(20)18-12-7-5-11(6-8-12)15(21)22-4/h5-9H,10H2,1-4H3,(H,18,20)