4-[(5-cyano-4-propan-2-yloxy-pyrimidin-2-yl)amino]-N-(2-piperidin-1-ylethyl)benzenesulfonamide

Systemtic Name: 4-[(5-cyano-4-propan-2-yloxy-pyrimidin-2-yl)amino]-N-(2-piperidin-1-ylethyl)benzenesulfonamide Openeye Name: 4-[(5-cyano-4-isopropoxy-pyrimidin-2-yl)amino]-N-[2-(1-piperidyl)ethyl]benzenesulfonamide CAS Name: 4-[(5-cyano-4-propan-2-yloxy-2-pyrimidinyl)amino]-N-[2-(1-piperidinyl)ethyl]benzenesulfonamide IUPAC Name: 4-[(5-cyano-4-propan-2-yloxypyrimidin-2-yl)amino]-N-(2-piperidin-1-ylethyl)benzenesulfonamide Traditional Name: 4-[(5-cyano-4-isopropoxy-pyrimidin-2-yl)amino]-N-(2-piperidinoethyl)benzenesulfonamide Formula: C21H28N6O3S MolecularWeight: 444.55042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NC(=NC=C1C#N)NC2=CC=C(C=C2)S(=O)(=O)NCCN3CCCCC3

Isomeric SMILES

CC(C)OC1=NC(=NC=C1C#N)NC2=CC=C(C=C2)S(=O)(=O)NCCN3CCCCC3

InChI

InChI=1S/C21H28N6O3S/c1-16(2)30-20-17(14-22)15-23-21(26-20)25-18-6-8-19(9-7-18)31(28,29)24-10-13-27-11-4-3-5-12-27/h6-9,15-16,24H,3-5,10-13H2,1-2H3,(H,23,25,26)