2-imidazol-1-yl-1-[4-(3-methylbutylsulfanyl)phenyl]ethanone

Systemtic Name: 2-imidazol-1-yl-1-[4-(3-methylbutylsulfanyl)phenyl]ethanone Openeye Name: 2-imidazol-1-yl-1-(4-isopentylsulfanylphenyl)ethanone CAS Name: 2-(1-imidazolyl)-1-[4-(3-methylbutylthio)phenyl]ethanone IUPAC Name: 2-imidazol-1-yl-1-[4-(3-methylbutylsulfanyl)phenyl]ethanone Traditional Name: 2-imidazol-1-yl-1-[4-(isoamylthio)phenyl]ethanone Formula: C16H20N2OS MolecularWeight: 288.4078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=CC=C(C=C1)C(=O)CN2C=CN=C2

Isomeric SMILES

CC(C)CCSC1=CC=C(C=C1)C(=O)CN2C=CN=C2

InChI

InChI=1S/C16H20N2OS/c1-13(2)7-10-20-15-5-3-14(4-6-15)16(19)11-18-9-8-17-12-18/h3-6,8-9,12-13H,7,10-11H2,1-2H3