ethyl 4-[2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylethanoylamino]butanoate

Systemtic Name: ethyl 4-[2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylethanoylamino]butanoate Openeye Name: ethyl 4-[[2-[1-(2-isopropylphenyl)imidazol-2-yl]sulfanylacetyl]amino]butanoate CAS Name: 4-[[1-oxo-2-[[1-(2-propan-2-ylphenyl)-2-imidazolyl]thio]ethyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[1-(2-propan-2-ylphenyl)imidazol-2-yl]sulfanylacetyl]amino]butanoate Traditional Name: 4-[[2-[(1-o-cumenylimidazol-2-yl)thio]acetyl]amino]butyric acid ethyl ester Formula: C20H27N3O3S MolecularWeight: 389.51168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCNC(=O)CSC1=NC=CN1C2=CC=CC=C2C(C)C

Isomeric SMILES

CCOC(=O)CCCNC(=O)CSC1=NC=CN1C2=CC=CC=C2C(C)C

InChI

InChI=1S/C20H27N3O3S/c1-4-26-19(25)10-7-11-21-18(24)14-27-20-22-12-13-23(20)17-9-6-5-8-16(17)15(2)3/h5-6,8-9,12-13,15H,4,7,10-11,14H2,1-3H3,(H,21,24)