methyl 4-ethyl-2-[4-[4-(2-methylbutan-2-yl)phenoxy]butanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 4-ethyl-2-[4-[4-(2-methylbutan-2-yl)phenoxy]butanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[4-[4-(1,1-dimethylpropyl)phenoxy]butanoylamino]-4-ethyl-thiazole-5-carboxylate CAS Name: 4-ethyl-2-[[4-[4-(2-methylbutan-2-yl)phenoxy]-1-oxobutyl]amino]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 4-ethyl-2-[4-[4-(2-methylbutan-2-yl)phenoxy]butanoylamino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[4-(4-tert-amylphenoxy)butanoylamino]-4-ethyl-thiazole-5-carboxylic acid methyl ester Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=N1)NC(=O)CCCOC2=CC=C(C=C2)C(C)(C)CC)C(=O)OC

Isomeric SMILES

CCC1=C(SC(=N1)NC(=O)CCCOC2=CC=C(C=C2)C(C)(C)CC)C(=O)OC

InChI

InChI=1S/C22H30N2O4S/c1-6-17-19(20(26)27-5)29-21(23-17)24-18(25)9-8-14-28-16-12-10-15(11-13-16)22(3,4)7-2/h10-13H,6-9,14H2,1-5H3,(H,23,24,25)