methyl 4-[1-imidazol-1-yl-2-(2-methoxyphenyl)propyl]sulfanylbenzoate

Systemtic Name: methyl 4-[1-imidazol-1-yl-2-(2-methoxyphenyl)propyl]sulfanylbenzoate Openeye Name: methyl 4-[1-imidazol-1-yl-2-(2-methoxyphenyl)propyl]sulfanylbenzoate CAS Name: 4-[[1-(1-imidazolyl)-2-(2-methoxyphenyl)propyl]thio]benzoic acid methyl ester IUPAC Name: methyl 4-[1-imidazol-1-yl-2-(2-methoxyphenyl)propyl]sulfanylbenzoate Traditional Name: 4-[[1-imidazol-1-yl-2-(2-methoxyphenyl)propyl]thio]benzoic acid methyl ester Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1OC)C(N2C=CN=C2)SC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC(C1=CC=CC=C1OC)C(N2C=CN=C2)SC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H22N2O3S/c1-15(18-6-4-5-7-19(18)25-2)20(23-13-12-22-14-23)27-17-10-8-16(9-11-17)21(24)26-3/h4-15,20H,1-3H3