[(2R)-1-[[4-(4-ethylphenyl)-1,3-thiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl] butanoate

Systemtic Name: [(2R)-1-[[4-(4-ethylphenyl)-1,3-thiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl] butanoate Openeye Name: [(1R)-2-[[4-(4-ethylphenyl)thiazol-2-yl]amino]-1-methyl-2-oxo-ethyl] butanoate CAS Name: butanoic acid [(2R)-1-[[4-(4-ethylphenyl)-2-thiazolyl]amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-[[4-(4-ethylphenyl)-1,3-thiazol-2-yl]amino]-1-oxopropan-2-yl] butanoate Traditional Name: butyric acid [(1R)-2-[[4-(4-ethylphenyl)thiazol-2-yl]amino]-2-keto-1-methyl-ethyl] ester Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(C)C(=O)NC1=NC(=CS1)C2=CC=C(C=C2)CC

Isomeric SMILES

CCCC(=O)O[C@H](C)C(=O)NC1=NC(=CS1)C2=CC=C(C=C2)CC

InChI

InChI=1S/C18H22N2O3S/c1-4-6-16(21)23-12(3)17(22)20-18-19-15(11-24-18)14-9-7-13(5-2)8-10-14/h7-12H,4-6H2,1-3H3,(H,19,20,22)/t12-/m1/s1