4-butoxy-N-[4-[(4-methyl-6-piperidin-1-yl-pyrimidin-2-yl)amino]phenyl]benzenesulfonamide

Systemtic Name: 4-butoxy-N-[4-[(4-methyl-6-piperidin-1-yl-pyrimidin-2-yl)amino]phenyl]benzenesulfonamide Openeye Name: 4-butoxy-N-[4-[[4-methyl-6-(1-piperidyl)pyrimidin-2-yl]amino]phenyl]benzenesulfonamide CAS Name: 4-butoxy-N-[4-[[4-methyl-6-(1-piperidinyl)-2-pyrimidinyl]amino]phenyl]benzenesulfonamide IUPAC Name: 4-butoxy-N-[4-[(4-methyl-6-piperidin-1-ylpyrimidin-2-yl)amino]phenyl]benzenesulfonamide Traditional Name: 4-butoxy-N-[4-[(4-methyl-6-piperidino-pyrimidin-2-yl)amino]phenyl]benzenesulfonamide Formula: C26H33N5O3S MolecularWeight: 495.63692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NC3=NC(=CC(=N3)N4CCCCC4)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NC3=NC(=CC(=N3)N4CCCCC4)C

InChI

InChI=1S/C26H33N5O3S/c1-3-4-18-34-23-12-14-24(15-13-23)35(32,33)30-22-10-8-21(9-11-22)28-26-27-20(2)19-25(29-26)31-16-6-5-7-17-31/h8-15,19,30H,3-7,16-18H2,1-2H3,(H,27,28,29)