[4-[[di(propan-2-yl)amino]methyl]phenyl]-(4-octylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [4-[[di(propan-2-yl)amino]methyl]phenyl]-(4-octylsulfonylpiperazin-1-yl)methanone Openeye Name: [4-[(diisopropylamino)methyl]phenyl]-(4-octylsulfonylpiperazin-1-yl)methanone CAS Name: [4-[[di(propan-2-yl)amino]methyl]phenyl]-(4-octylsulfonyl-1-piperazinyl)methanone IUPAC Name: [4-[[di(propan-2-yl)amino]methyl]phenyl]-(4-octylsulfonylpiperazin-1-yl)methanone Traditional Name: [4-[(diisopropylamino)methyl]phenyl]-(4-octylsulfonylpiperazino)methanone Formula: C26H45N3O3S MolecularWeight: 479.7188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)CN(C(C)C)C(C)C

Isomeric SMILES

CCCCCCCCS(=O)(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)CN(C(C)C)C(C)C

InChI

InChI=1S/C26H45N3O3S/c1-6-7-8-9-10-11-20-33(31,32)28-18-16-27(17-19-28)26(30)25-14-12-24(13-15-25)21-29(22(2)3)23(4)5/h12-15,22-23H,6-11,16-21H2,1-5H3