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

Systemtic Name: butyl 4-[2-[2-(2,2-dimethylpropanoylamino)-1,3-thiazol-4-yl]ethanoylamino]benzoate Openeye Name: butyl 4-[[2-[2-(2,2-dimethylpropanoylamino)thiazol-4-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[2-[(2,2-dimethyl-1-oxopropyl)amino]-4-thiazolyl]-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-[2-(2,2-dimethylpropanoylamino)-1,3-thiazol-4-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[2-(pivaloylamino)thiazol-4-yl]acetyl]amino]benzoic acid butyl ester Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)C(C)(C)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)C(C)(C)C

InChI

InChI=1S/C21H27N3O4S/c1-5-6-11-28-18(26)14-7-9-15(10-8-14)22-17(25)12-16-13-29-20(23-16)24-19(27)21(2,3)4/h7-10,13H,5-6,11-12H2,1-4H3,(H,22,25)(H,23,24,27)