6-cyclohexyl-4-(4-methylphenyl)sulfonyl-1-[1-(triphenylmethyl)imidazol-4-yl]hexan-3-one

Systemtic Name: 6-cyclohexyl-4-(4-methylphenyl)sulfonyl-1-[1-(triphenylmethyl)imidazol-4-yl]hexan-3-one Openeye Name: 6-cyclohexyl-4-(p-tolylsulfonyl)-1-(1-tritylimidazol-4-yl)hexan-3-one CAS Name: 6-cyclohexyl-4-(4-methylphenyl)sulfonyl-1-[1-(triphenylmethyl)-4-imidazolyl]-3-hexanone IUPAC Name: 6-cyclohexyl-4-(4-methylphenyl)sulfonyl-1-(1-tritylimidazol-4-yl)hexan-3-one Traditional Name: 6-cyclohexyl-4-tosyl-1-(1-tritylimidazol-4-yl)hexan-3-one Formula: C41H44N2O3S MolecularWeight: 644.86466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CCC2CCCCC2)C(=O)CCC3=CN(C=N3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CCC2CCCCC2)C(=O)CCC3=CN(C=N3)C(C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C41H44N2O3S/c1-32-22-26-38(27-23-32)47(45,46)40(29-24-33-14-6-2-7-15-33)39(44)28-25-37-30-43(31-42-37)41(34-16-8-3-9-17-34,35-18-10-4-11-19-35)36-20-12-5-13-21-36/h3-5,8-13,16-23,26-27,30-31,33,40H,2,6-7,14-15,24-25,28-29H2,1H3