7-(1H-imidazol-2-yl)-1-(4-methylsulfanylphenyl)heptan-1-one

Systemtic Name: 7-(1H-imidazol-2-yl)-1-(4-methylsulfanylphenyl)heptan-1-one Openeye Name: 7-(1H-imidazol-2-yl)-1-(4-methylsulfanylphenyl)heptan-1-one CAS Name: 7-(1H-imidazol-2-yl)-1-[4-(methylthio)phenyl]-1-heptanone IUPAC Name: 7-(1H-imidazol-2-yl)-1-(4-methylsulfanylphenyl)heptan-1-one Traditional Name: 7-(1H-imidazol-2-yl)-1-[4-(methylthio)phenyl]heptan-1-one Formula: C17H22N2OS MolecularWeight: 302.43438

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)CCCCCCC2=NC=CN2

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)CCCCCCC2=NC=CN2

InChI

InChI=1S/C17H22N2OS/c1-21-15-10-8-14(9-11-15)16(20)6-4-2-3-5-7-17-18-12-13-19-17/h8-13H,2-7H2,1H3,(H,18,19)