N-[5-(1-ethylpiperidin-4-yl)sulfanylpyridin-2-yl]-5-fluoranyl-4-(7-fluoranyl-2-methyl-3-propan-2-yl-benzimidazol-5-yl)pyrimidin-2-amine

Systemtic Name: N-[5-(1-ethylpiperidin-4-yl)sulfanylpyridin-2-yl]-5-fluoranyl-4-(7-fluoranyl-2-methyl-3-propan-2-yl-benzimidazol-5-yl)pyrimidin-2-amine Openeye Name: N-[5-[(1-ethyl-4-piperidyl)sulfanyl]-2-pyridyl]-5-fluoro-4-(7-fluoro-3-isopropyl-2-methyl-benzimidazol-5-yl)pyrimidin-2-amine CAS Name: N-[5-[(1-ethyl-4-piperidinyl)thio]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-yl-5-benzimidazolyl)-2-pyrimidinamine IUPAC Name: N-[5-(1-ethylpiperidin-4-yl)sulfanylpyridin-2-yl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine Traditional Name: [5-[(1-ethyl-4-piperidyl)thio]-2-pyridyl]-[5-fluoro-4-(7-fluoro-3-isopropyl-2-methyl-benzimidazol-5-yl)pyrimidin-2-yl]amine Formula: C27H31F2N7S MolecularWeight: 523.643746

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)SC2=CN=C(C=C2)NC3=NC=C(C(=N3)C4=CC5=C(C(=C4)F)N=C(N5C(C)C)C)F

Isomeric SMILES

CCN1CCC(CC1)SC2=CN=C(C=C2)NC3=NC=C(C(=N3)C4=CC5=C(C(=C4)F)N=C(N5C(C)C)C)F

InChI

InChI=1S/C27H31F2N7S/c1-5-35-10-8-19(9-11-35)37-20-6-7-24(30-14-20)33-27-31-15-22(29)25(34-27)18-12-21(28)26-23(13-18)36(16(2)3)17(4)32-26/h6-7,12-16,19H,5,8-11H2,1-4H3,(H,30,31,33,34)