[4-azanyl-2-[[1-(3-pyrrolidin-1-ylpropylsulfonyl)piperidin-4-yl]amino]pyrimidin-5-yl]-(5-fluoranyl-2-methoxy-phenyl)methanone

Systemtic Name: [4-azanyl-2-[[1-(3-pyrrolidin-1-ylpropylsulfonyl)piperidin-4-yl]amino]pyrimidin-5-yl]-(5-fluoranyl-2-methoxy-phenyl)methanone Openeye Name: [4-amino-2-[[1-(3-pyrrolidin-1-ylpropylsulfonyl)-4-piperidyl]amino]pyrimidin-5-yl]-(5-fluoro-2-methoxy-phenyl)methanone CAS Name: [4-amino-2-[[1-[3-(1-pyrrolidinyl)propylsulfonyl]-4-piperidinyl]amino]-5-pyrimidinyl]-(5-fluoro-2-methoxyphenyl)methanone IUPAC Name: [4-amino-2-[[1-(3-pyrrolidin-1-ylpropylsulfonyl)piperidin-4-yl]amino]pyrimidin-5-yl]-(5-fluoro-2-methoxyphenyl)methanone Traditional Name: [4-amino-2-[[1-(3-pyrrolidinopropylsulfonyl)-4-piperidyl]amino]pyrimidin-5-yl]-(5-fluoro-2-methoxy-phenyl)methanone Formula: C24H33FN6O4S MolecularWeight: 520.620023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)C(=O)C2=CN=C(N=C2N)NC3CCN(CC3)S(=O)(=O)CCCN4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)F)C(=O)C2=CN=C(N=C2N)NC3CCN(CC3)S(=O)(=O)CCCN4CCCC4

InChI

InChI=1S/C24H33FN6O4S/c1-35-21-6-5-17(25)15-19(21)22(32)20-16-27-24(29-23(20)26)28-18-7-12-31(13-8-18)36(33,34)14-4-11-30-9-2-3-10-30/h5-6,15-16,18H,2-4,7-14H2,1H3,(H3,26,27,28,29)