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cyclohexyl 2-[(2-fluorophenyl)methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

cyclohexyl 2-[(2-fluorophenyl)methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name:cyclohexyl 2-[(2-fluorophenyl)methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate
Openeye Name:cyclohexyl 2-[(2-fluorophenyl)methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate
CAS Name:2-[(2-fluorophenyl)methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid cyclohexyl ester
IUPAC Name:cyclohexyl 2-[(2-fluorophenyl)methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate
Traditional Name:2-(2-fluorobenzyl)-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid cyclohexyl ester
Formula: C21H21FN2O3S
MolecularWeight: 400.466443
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CC3=CC=CC=C3F)C(=O)OC4CCCCC4


Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CC3=CC=CC=C3F)C(=O)OC4CCCCC4


InChI

InChI=1S/C21H21FN2O3S/c1-12-17-19(25)23-16(11-13-7-5-6-10-15(13)22)24-20(17)28-18(12)21(26)27-14-8-3-2-4-9-14/h5-7,10,14H,2-4,8-9,11H2,1H3,(H,23,24,25)


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