cyclohexyl-(3-naphthalen-1-ylsulfonyl-3,6-diazabicyclo[3.1.1]heptan-6-yl)methanone

Systemtic Name: cyclohexyl-(3-naphthalen-1-ylsulfonyl-3,6-diazabicyclo[3.1.1]heptan-6-yl)methanone Openeye Name: cyclohexyl-[3-(1-naphthylsulfonyl)-3,6-diazabicyclo[3.1.1]heptan-6-yl]methanone CAS Name: cyclohexyl-[3-(1-naphthalenylsulfonyl)-3,6-diazabicyclo[3.1.1]heptan-6-yl]methanone IUPAC Name: cyclohexyl-(3-naphthalen-1-ylsulfonyl-3,6-diazabicyclo[3.1.1]heptan-6-yl)methanone Traditional Name: cyclohexyl-[3-(1-naphthylsulfonyl)-3,6-diazabicyclo[3.1.1]heptan-6-yl]methanone Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N2C3CC2CN(C3)S(=O)(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CCC(CC1)C(=O)N2C3CC2CN(C3)S(=O)(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C22H26N2O3S/c25-22(17-8-2-1-3-9-17)24-18-13-19(24)15-23(14-18)28(26,27)21-12-6-10-16-7-4-5-11-20(16)21/h4-7,10-12,17-19H,1-3,8-9,13-15H2