N-[5-[(2-fluoranyl-4-methyl-phenyl)amino]-[1,3]thiazolo[5,4-b]pyridin-2-yl]-2-(4-methylpiperazin-1-yl)carbonyl-cyclopropane-1-carboxamide

Systemtic Name: N-[5-[(2-fluoranyl-4-methyl-phenyl)amino]-[1,3]thiazolo[5,4-b]pyridin-2-yl]-2-(4-methylpiperazin-1-yl)carbonyl-cyclopropane-1-carboxamide Openeye Name: N-[5-(2-fluoro-4-methyl-anilino)thiazolo[5,4-b]pyridin-2-yl]-2-(4-methylpiperazine-1-carbonyl)cyclopropanecarboxamide CAS Name: N-[5-(2-fluoro-4-methylanilino)-2-thiazolo[5,4-b]pyridinyl]-2-[(4-methyl-1-piperazinyl)-oxomethyl]-1-cyclopropanecarboxamide IUPAC Name: N-[5-(2-fluoro-4-methylanilino)-[1,3]thiazolo[5,4-b]pyridin-2-yl]-2-(4-methylpiperazine-1-carbonyl)cyclopropane-1-carboxamide Traditional Name: N-[5-(2-fluoro-4-methyl-anilino)thiazolo[5,4-b]pyridin-2-yl]-2-(4-methylpiperazine-1-carbonyl)cyclopropanecarboxamide Formula: C23H25FN6O2S MolecularWeight: 468.547003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=NC3=C(C=C2)N=C(S3)NC(=O)C4CC4C(=O)N5CCN(CC5)C)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=NC3=C(C=C2)N=C(S3)NC(=O)C4CC4C(=O)N5CCN(CC5)C)F

InChI

InChI=1S/C23H25FN6O2S/c1-13-3-4-17(16(24)11-13)25-19-6-5-18-21(27-19)33-23(26-18)28-20(31)14-12-15(14)22(32)30-9-7-29(2)8-10-30/h3-6,11,14-15H,7-10,12H2,1-2H3,(H,25,27)(H,26,28,31)