4-[[4-(3-fluoranyl-4-methoxy-phenyl)pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide

Systemtic Name: 4-[[4-(3-fluoranyl-4-methoxy-phenyl)pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide Openeye Name: 4-[[4-(3-fluoro-4-methoxy-phenyl)pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide CAS Name: 4-[[4-(3-fluoro-4-methoxyphenyl)-2-pyrimidinyl]amino]-N-[2-(1-pyrrolidinyl)ethyl]benzenesulfonamide IUPAC Name: 4-[[4-(3-fluoro-4-methoxyphenyl)pyrimidin-2-yl]amino]-N-(2-pyrrolidin-1-ylethyl)benzenesulfonamide Traditional Name: 4-[[4-(3-fluoro-4-methoxy-phenyl)pyrimidin-2-yl]amino]-N-(2-pyrrolidinoethyl)benzenesulfonamide Formula: C23H26FN5O3S MolecularWeight: 471.547643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=NC=C2)NC3=CC=C(C=C3)S(=O)(=O)NCCN4CCCC4)F

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=NC=C2)NC3=CC=C(C=C3)S(=O)(=O)NCCN4CCCC4)F

InChI

InChI=1S/C23H26FN5O3S/c1-32-22-9-4-17(16-20(22)24)21-10-11-25-23(28-21)27-18-5-7-19(8-6-18)33(30,31)26-12-15-29-13-2-3-14-29/h4-11,16,26H,2-3,12-15H2,1H3,(H,25,27,28)