N-(3-chloranyl-4-fluoranyl-phenyl)-5-methyl-4-oxidanylidene-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-5-methyl-4-oxidanylidene-3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-5-methyl-4-oxo-3-[2-oxo-2-(1-piperidyl)ethyl]thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-(3-chloro-4-fluorophenyl)-5-methyl-4-oxo-3-[2-oxo-2-(1-piperidinyl)ethyl]-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-5-methyl-4-oxo-3-(2-oxo-2-piperidin-1-ylethyl)thieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-4-keto-3-(2-keto-2-piperidino-ethyl)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C21H20ClFN4O3S MolecularWeight: 462.924903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)N3CCCCC3)C(=O)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)N3CCCCC3)C(=O)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C21H20ClFN4O3S/c1-12-17-20(31-18(12)19(29)25-13-5-6-15(23)14(22)9-13)24-11-27(21(17)30)10-16(28)26-7-3-2-4-8-26/h5-6,9,11H,2-4,7-8,10H2,1H3,(H,25,29)