2-hexan-3-yl-4-[(4-methoxyphenyl)methylsulfanyl]-1H-imidazole-5-carboxylate

Systemtic Name: 2-hexan-3-yl-4-[(4-methoxyphenyl)methylsulfanyl]-1H-imidazole-5-carboxylate Openeye Name: 2-(1-ethylbutyl)-4-[(4-methoxyphenyl)methylsulfanyl]-1H-imidazole-5-carboxylate CAS Name: 2-hexan-3-yl-4-[(4-methoxyphenyl)methylthio]-1H-imidazole-5-carboxylate IUPAC Name: 2-hexan-3-yl-4-[(4-methoxyphenyl)methylsulfanyl]-1H-imidazole-5-carboxylate Traditional Name: 2-(1-ethylbutyl)-4-(p-anisylthio)-1H-imidazole-5-carboxylate Formula: C18H23N2O3S- MolecularWeight: 347.45182

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)C1=NC(=C(N1)C(=O)[O-])SCC2=CC=C(C=C2)OC

Isomeric SMILES

CCCC(CC)C1=NC(=C(N1)C(=O)[O-])SCC2=CC=C(C=C2)OC

InChI

InChI=1S/C18H24N2O3S/c1-4-6-13(5-2)16-19-15(18(21)22)17(20-16)24-11-12-7-9-14(23-3)10-8-12/h7-10,13H,4-6,11H2,1-3H3,(H,19,20)(H,21,22)/p-1