7-imidazol-1-yl-1-(4-methylsulfonylphenyl)heptan-1-one

Systemtic Name: 7-imidazol-1-yl-1-(4-methylsulfonylphenyl)heptan-1-one Openeye Name: 7-imidazol-1-yl-1-(4-methylsulfonylphenyl)heptan-1-one CAS Name: 7-(1-imidazolyl)-1-(4-methylsulfonylphenyl)-1-heptanone IUPAC Name: 7-imidazol-1-yl-1-(4-methylsulfonylphenyl)heptan-1-one Traditional Name: 7-imidazol-1-yl-1-(4-mesylphenyl)heptan-1-one Formula: C17H22N2O3S MolecularWeight: 334.43318

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)CCCCCCN2C=CN=C2

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)CCCCCCN2C=CN=C2

InChI

InChI=1S/C17H22N2O3S/c1-23(21,22)16-9-7-15(8-10-16)17(20)6-4-2-3-5-12-19-13-11-18-14-19/h7-11,13-14H,2-6,12H2,1H3