methyl 3-imidazol-1-yl-3-phenyl-3-phenylsulfanyl-propanoate

Systemtic Name: methyl 3-imidazol-1-yl-3-phenyl-3-phenylsulfanyl-propanoate Openeye Name: methyl 3-imidazol-1-yl-3-phenyl-3-phenylsulfanyl-propanoate CAS Name: 3-(1-imidazolyl)-3-phenyl-3-(phenylthio)propanoic acid methyl ester IUPAC Name: methyl 3-imidazol-1-yl-3-phenyl-3-phenylsulfanylpropanoate Traditional Name: 3-imidazol-1-yl-3-phenyl-3-(phenylthio)propionic acid methyl ester Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)(N2C=CN=C2)SC3=CC=CC=C3

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1)(N2C=CN=C2)SC3=CC=CC=C3

InChI

InChI=1S/C19H18N2O2S/c1-23-18(22)14-19(21-13-12-20-15-21,16-8-4-2-5-9-16)24-17-10-6-3-7-11-17/h2-13,15H,14H2,1H3