methyl 1-[[2-methyl-3-[2-(phenylcarbamoyloxy)ethylsulfanyl]phenyl]methyl]imidazole-4-carboxylate

Systemtic Name: methyl 1-[[2-methyl-3-[2-(phenylcarbamoyloxy)ethylsulfanyl]phenyl]methyl]imidazole-4-carboxylate Openeye Name: methyl 1-[[2-methyl-3-[2-(phenylcarbamoyloxy)ethylsulfanyl]phenyl]methyl]imidazole-4-carboxylate CAS Name: 1-[[3-[2-[anilino(oxo)methoxy]ethylthio]-2-methylphenyl]methyl]-4-imidazolecarboxylic acid methyl ester IUPAC Name: methyl 1-[[2-methyl-3-[2-(phenylcarbamoyloxy)ethylsulfanyl]phenyl]methyl]imidazole-4-carboxylate Traditional Name: 1-[2-methyl-3-[2-(phenylcarbamoyloxy)ethylthio]benzyl]imidazole-4-carboxylic acid methyl ester Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1SCCOC(=O)NC2=CC=CC=C2)CN3C=C(N=C3)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1SCCOC(=O)NC2=CC=CC=C2)CN3C=C(N=C3)C(=O)OC

InChI

InChI=1S/C22H23N3O4S/c1-16-17(13-25-14-19(23-15-25)21(26)28-2)7-6-10-20(16)30-12-11-29-22(27)24-18-8-4-3-5-9-18/h3-10,14-15H,11-13H2,1-2H3,(H,24,27)