7-cyclohexyl-3-cyclopropyl-4-oxidanyl-5-(phenylsulfonyl)-1-[3-(triphenylmethyl)imidazol-4-yl]heptan-1-one

Systemtic Name: 7-cyclohexyl-3-cyclopropyl-4-oxidanyl-5-(phenylsulfonyl)-1-[3-(triphenylmethyl)imidazol-4-yl]heptan-1-one Openeye Name: 5-(benzenesulfonyl)-7-cyclohexyl-3-cyclopropyl-4-hydroxy-1-(3-tritylimidazol-4-yl)heptan-1-one CAS Name: 5-(benzenesulfonyl)-7-cyclohexyl-3-cyclopropyl-4-hydroxy-1-[3-(triphenylmethyl)-4-imidazolyl]-1-heptanone IUPAC Name: 5-(benzenesulfonyl)-7-cyclohexyl-3-cyclopropyl-4-hydroxy-1-(3-tritylimidazol-4-yl)heptan-1-one Traditional Name: 5-besyl-7-cyclohexyl-3-cyclopropyl-4-hydroxy-1-(3-tritylimidazol-4-yl)heptan-1-one Formula: C44H48N2O4S MolecularWeight: 700.92792

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(C(C(CC(=O)C2=CN=CN2C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C6CC6)O)S(=O)(=O)C7=CC=CC=C7

Isomeric SMILES

C1CCC(CC1)CCC(C(C(CC(=O)C2=CN=CN2C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)C6CC6)O)S(=O)(=O)C7=CC=CC=C7

InChI

InChI=1S/C44H48N2O4S/c47-41(30-39(34-27-28-34)43(48)42(29-26-33-16-6-1-7-17-33)51(49,50)38-24-14-5-15-25-38)40-31-45-32-46(40)44(35-18-8-2-9-19-35,36-20-10-3-11-21-36)37-22-12-4-13-23-37/h2-5,8-15,18-25,31-34,39,42-43,48H,1,6-7,16-17,26-30H2