methyl 2-[3-[(2-chlorophenyl)methyl]-2-propylsulfanyl-imidazol-4-yl]ethanoate

Systemtic Name: methyl 2-[3-[(2-chlorophenyl)methyl]-2-propylsulfanyl-imidazol-4-yl]ethanoate Openeye Name: methyl 2-[3-[(2-chlorophenyl)methyl]-2-propylsulfanyl-imidazol-4-yl]acetate CAS Name: 2-[3-[(2-chlorophenyl)methyl]-2-(propylthio)-4-imidazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-[(2-chlorophenyl)methyl]-2-propylsulfanylimidazol-4-yl]acetate Traditional Name: 2-[3-(2-chlorobenzyl)-2-(propylthio)imidazol-4-yl]acetic acid methyl ester Formula: C16H19ClN2O2S MolecularWeight: 338.85226

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NC=C(N1CC2=CC=CC=C2Cl)CC(=O)OC

Isomeric SMILES

CCCSC1=NC=C(N1CC2=CC=CC=C2Cl)CC(=O)OC

InChI

InChI=1S/C16H19ClN2O2S/c1-3-8-22-16-18-10-13(9-15(20)21-2)19(16)11-12-6-4-5-7-14(12)17/h4-7,10H,3,8-9,11H2,1-2H3