N4-[5-(3-ethoxyphenyl)sulfonyl-1,3-thiazol-2-yl]-5-fluoranyl-2-methyl-N6-(2-pyrrolidin-1-ylethyl)pyrimidine-4,6-diamine

Systemtic Name: N4-[5-(3-ethoxyphenyl)sulfonyl-1,3-thiazol-2-yl]-5-fluoranyl-2-methyl-N6-(2-pyrrolidin-1-ylethyl)pyrimidine-4,6-diamine Openeye Name: N4-[5-(3-ethoxyphenyl)sulfonylthiazol-2-yl]-5-fluoro-2-methyl-N6-(2-pyrrolidin-1-ylethyl)pyrimidine-4,6-diamine CAS Name: N4-[5-(3-ethoxyphenyl)sulfonyl-2-thiazolyl]-5-fluoro-2-methyl-N6-[2-(1-pyrrolidinyl)ethyl]pyrimidine-4,6-diamine IUPAC Name: 4-N-[5-(3-ethoxyphenyl)sulfonyl-1,3-thiazol-2-yl]-5-fluoro-2-methyl-6-N-(2-pyrrolidin-1-ylethyl)pyrimidine-4,6-diamine Traditional Name: [5-fluoro-2-methyl-6-[(5-m-phenetylsulfonylthiazol-2-yl)amino]pyrimidin-4-yl]-(2-pyrrolidinoethyl)amine Formula: C22H27FN6O3S2 MolecularWeight: 506.616583

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC=C1)S(=O)(=O)C2=CN=C(S2)NC3=C(C(=NC(=N3)C)NCCN4CCCC4)F

Isomeric SMILES

CCOC1=CC(=CC=C1)S(=O)(=O)C2=CN=C(S2)NC3=C(C(=NC(=N3)C)NCCN4CCCC4)F

InChI

InChI=1S/C22H27FN6O3S2/c1-3-32-16-7-6-8-17(13-16)34(30,31)18-14-25-22(33-18)28-21-19(23)20(26-15(2)27-21)24-9-12-29-10-4-5-11-29/h6-8,13-14H,3-5,9-12H2,1-2H3,(H2,24,25,26,27,28)