1-[3-[(3-fluorophenyl)methyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-6-yl]carbonylpiperidine-4-carboxamide

Systemtic Name: 1-[3-[(3-fluorophenyl)methyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidin-6-yl]carbonylpiperidine-4-carboxamide Openeye Name: 1-[3-[(3-fluorophenyl)methyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[3-[(3-fluorophenyl)methyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinyl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[3-[(3-fluorophenyl)methyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[3-(3-fluorobenzyl)-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carbonyl]isonipecotamide Formula: C21H21FN4O3S MolecularWeight: 428.479843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC(=CC=C3)F)C(=O)N4CCC(CC4)C(=O)N

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC3=CC(=CC=C3)F)C(=O)N4CCC(CC4)C(=O)N

InChI

InChI=1S/C21H21FN4O3S/c1-12-16-19(24-11-26(20(16)28)10-13-3-2-4-15(22)9-13)30-17(12)21(29)25-7-5-14(6-8-25)18(23)27/h2-4,9,11,14H,5-8,10H2,1H3,(H2,23,27)