methyl 4-[3-[4-(4-chlorophenyl)-2-phenyl-1,3-thiazol-5-yl]propanoylamino]benzoate

Systemtic Name: methyl 4-[3-[4-(4-chlorophenyl)-2-phenyl-1,3-thiazol-5-yl]propanoylamino]benzoate Openeye Name: methyl 4-[3-[4-(4-chlorophenyl)-2-phenyl-thiazol-5-yl]propanoylamino]benzoate CAS Name: 4-[[3-[4-(4-chlorophenyl)-2-phenyl-5-thiazolyl]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[4-(4-chlorophenyl)-2-phenyl-1,3-thiazol-5-yl]propanoylamino]benzoate Traditional Name: 4-[3-[4-(4-chlorophenyl)-2-phenyl-thiazol-5-yl]propanoylamino]benzoic acid methyl ester Formula: C26H21ClN2O3S MolecularWeight: 476.97454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CCC2=C(N=C(S2)C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CCC2=C(N=C(S2)C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H21ClN2O3S/c1-32-26(31)19-9-13-21(14-10-19)28-23(30)16-15-22-24(17-7-11-20(27)12-8-17)29-25(33-22)18-5-3-2-4-6-18/h2-14H,15-16H2,1H3,(H,28,30)