N-cycloheptyl-2-[5-(4-fluorophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanamide

Systemtic Name: N-cycloheptyl-2-[5-(4-fluorophenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]ethanamide Openeye Name: N-cycloheptyl-2-[5-(4-fluorophenyl)-4-oxo-thieno[2,3-d]pyrimidin-3-yl]acetamide CAS Name: N-cycloheptyl-2-[5-(4-fluorophenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]acetamide IUPAC Name: N-cycloheptyl-2-[5-(4-fluorophenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]acetamide Traditional Name: N-cycloheptyl-2-[5-(4-fluorophenyl)-4-keto-thieno[2,3-d]pyrimidin-3-yl]acetamide Formula: C21H22FN3O2S MolecularWeight: 399.481683

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CCCC(CC1)NC(=O)CN2C=NC3=C(C2=O)C(=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FN3O2S/c22-15-9-7-14(8-10-15)17-12-28-20-19(17)21(27)25(13-23-20)11-18(26)24-16-5-3-1-2-4-6-16/h7-10,12-13,16H,1-6,11H2,(H,24,26)