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

Systemtic Name: [(2R)-1-[[4-(4-ethylphenyl)-1,3-thiazol-2-yl]amino]-1-oxidanylidene-propan-2-yl] 4-methanoylbenzoate Openeye Name: [(1R)-2-[[4-(4-ethylphenyl)thiazol-2-yl]amino]-1-methyl-2-oxo-ethyl] 4-formylbenzoate CAS Name: 4-formylbenzoic 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] 4-formylbenzoate Traditional Name: 4-formylbenzoic acid [(1R)-2-[[4-(4-ethylphenyl)thiazol-2-yl]amino]-2-keto-1-methyl-ethyl] ester Formula: C22H20N2O4S MolecularWeight: 408.4702

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C(C)OC(=O)C3=CC=C(C=C3)C=O

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)[C@@H](C)OC(=O)C3=CC=C(C=C3)C=O

InChI

InChI=1S/C22H20N2O4S/c1-3-15-4-8-17(9-5-15)19-13-29-22(23-19)24-20(26)14(2)28-21(27)18-10-6-16(12-25)7-11-18/h4-14H,3H2,1-2H3,(H,23,24,26)/t14-/m1/s1