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

Systemtic Name: methyl 4-[3-[2-(benzimidazol-1-yl)-4-(4-chlorophenyl)-1,3-oxazol-5-yl]propanoylamino]benzoate Openeye Name: methyl 4-[3-[2-(benzimidazol-1-yl)-4-(4-chlorophenyl)oxazol-5-yl]propanoylamino]benzoate CAS Name: 4-[[3-[2-(1-benzimidazolyl)-4-(4-chlorophenyl)-5-oxazolyl]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[2-(benzimidazol-1-yl)-4-(4-chlorophenyl)-1,3-oxazol-5-yl]propanoylamino]benzoate Traditional Name: 4-[3-[2-(benzimidazol-1-yl)-4-(4-chlorophenyl)oxazol-5-yl]propanoylamino]benzoic acid methyl ester Formula: C27H21ClN4O4 MolecularWeight: 500.93304

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CCC2=C(N=C(O2)N3C=NC4=CC=CC=C43)C5=CC=C(C=C5)Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CCC2=C(N=C(O2)N3C=NC4=CC=CC=C43)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H21ClN4O4/c1-35-26(34)18-8-12-20(13-9-18)30-24(33)15-14-23-25(17-6-10-19(28)11-7-17)31-27(36-23)32-16-29-21-4-2-3-5-22(21)32/h2-13,16H,14-15H2,1H3,(H,30,33)