methyl 4-[[4-(4-ethoxyphenyl)-5-ethyl-1,3-thiazol-2-yl]-(2-phenylethanoyl)amino]benzoate

Systemtic Name: methyl 4-[[4-(4-ethoxyphenyl)-5-ethyl-1,3-thiazol-2-yl]-(2-phenylethanoyl)amino]benzoate Openeye Name: methyl 4-[[4-(4-ethoxyphenyl)-5-ethyl-thiazol-2-yl]-(2-phenylacetyl)amino]benzoate CAS Name: 4-[[4-(4-ethoxyphenyl)-5-ethyl-2-thiazolyl]-(1-oxo-2-phenylethyl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-(4-ethoxyphenyl)-5-ethyl-1,3-thiazol-2-yl]-(2-phenylacetyl)amino]benzoate Traditional Name: 4-[(5-ethyl-4-p-phenetyl-thiazol-2-yl)-(2-phenylacetyl)amino]benzoic acid methyl ester Formula: C29H28N2O4S MolecularWeight: 500.60862

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(S1)N(C2=CC=C(C=C2)C(=O)OC)C(=O)CC3=CC=CC=C3)C4=CC=C(C=C4)OCC

Isomeric SMILES

CCC1=C(N=C(S1)N(C2=CC=C(C=C2)C(=O)OC)C(=O)CC3=CC=CC=C3)C4=CC=C(C=C4)OCC

InChI

InChI=1S/C29H28N2O4S/c1-4-25-27(21-13-17-24(18-14-21)35-5-2)30-29(36-25)31(26(32)19-20-9-7-6-8-10-20)23-15-11-22(12-16-23)28(33)34-3/h6-18H,4-5,19H2,1-3H3