3-[3-methyl-5-[[octylsulfonyl(piperidin-4-ylmethyl)amino]methyl]phenyl]benzenecarboximidamide

Systemtic Name: 3-[3-methyl-5-[[octylsulfonyl(piperidin-4-ylmethyl)amino]methyl]phenyl]benzenecarboximidamide Openeye Name: 3-[3-methyl-5-[[octylsulfonyl(4-piperidylmethyl)amino]methyl]phenyl]benzamidine CAS Name: 3-[3-methyl-5-[[octylsulfonyl(4-piperidinylmethyl)amino]methyl]phenyl]benzenecarboximidamide IUPAC Name: 3-[3-methyl-5-[[octylsulfonyl(piperidin-4-ylmethyl)amino]methyl]phenyl]benzenecarboximidamide Traditional Name: 3-[3-methyl-5-[[octylsulfonyl(4-piperidylmethyl)amino]methyl]phenyl]benzamidine Formula: C29H44N4O2S MolecularWeight: 512.75026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)N(CC1CCNCC1)CC2=CC(=CC(=C2)C)C3=CC(=CC=C3)C(=N)N

Isomeric SMILES

CCCCCCCCS(=O)(=O)N(CC1CCNCC1)CC2=CC(=CC(=C2)C)C3=CC(=CC=C3)C(=N)N

InChI

InChI=1S/C29H44N4O2S/c1-3-4-5-6-7-8-16-36(34,35)33(21-24-12-14-32-15-13-24)22-25-17-23(2)18-28(19-25)26-10-9-11-27(20-26)29(30)31/h9-11,17-20,24,32H,3-8,12-16,21-22H2,1-2H3,(H3,30,31)