3-[(4-fluoranyl-3-methyl-phenyl)amino]-7-phenyl-2-piperidin-4-ylcarbonyl-thieno[2,3-b]pyridin-6-one

Systemtic Name: 3-[(4-fluoranyl-3-methyl-phenyl)amino]-7-phenyl-2-piperidin-4-ylcarbonyl-thieno[2,3-b]pyridin-6-one Openeye Name: 3-(4-fluoro-3-methyl-anilino)-7-phenyl-2-(piperidine-4-carbonyl)thieno[2,3-b]pyridin-6-one CAS Name: 3-(4-fluoro-3-methylanilino)-2-[oxo(4-piperidinyl)methyl]-7-phenyl-6-thieno[2,3-b]pyridinone IUPAC Name: 3-(4-fluoro-3-methylanilino)-7-phenyl-2-(piperidine-4-carbonyl)thieno[2,3-b]pyridin-6-one Traditional Name: 3-(4-fluoro-3-methyl-anilino)-2-isonipecotoyl-7-phenyl-thieno[2,3-b]pyridin-6-one Formula: C26H24FN3O2S MolecularWeight: 461.551063

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=C(SC3=C2C=CC(=O)N3C4=CC=CC=C4)C(=O)C5CCNCC5)F

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=C(SC3=C2C=CC(=O)N3C4=CC=CC=C4)C(=O)C5CCNCC5)F

InChI

InChI=1S/C26H24FN3O2S/c1-16-15-18(7-9-21(16)27)29-23-20-8-10-22(31)30(19-5-3-2-4-6-19)26(20)33-25(23)24(32)17-11-13-28-14-12-17/h2-10,15,17,28-29H,11-14H2,1H3