methyl 3-[[1-[(4-chlorophenyl)methyl]-5-phenyl-imidazol-2-yl]sulfanylmethyl]benzoate

Systemtic Name: methyl 3-[[1-[(4-chlorophenyl)methyl]-5-phenyl-imidazol-2-yl]sulfanylmethyl]benzoate Openeye Name: methyl 3-[[1-[(4-chlorophenyl)methyl]-5-phenyl-imidazol-2-yl]sulfanylmethyl]benzoate CAS Name: 3-[[[1-[(4-chlorophenyl)methyl]-5-phenyl-2-imidazolyl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[1-[(4-chlorophenyl)methyl]-5-phenylimidazol-2-yl]sulfanylmethyl]benzoate Traditional Name: 3-[[[1-(4-chlorobenzyl)-5-phenyl-imidazol-2-yl]thio]methyl]benzoic acid methyl ester Formula: C25H21ClN2O2S MolecularWeight: 448.96444

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CSC2=NC=C(N2CC3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CSC2=NC=C(N2CC3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C25H21ClN2O2S/c1-30-24(29)21-9-5-6-19(14-21)17-31-25-27-15-23(20-7-3-2-4-8-20)28(25)16-18-10-12-22(26)13-11-18/h2-15H,16-17H2,1H3