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7-(1-adamantyl)-1-cyclopropyl-2-sulfanylidene-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one

7-(1-adamantyl)-1-cyclopropyl-2-sulfanylidene-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one

Systemtic Name:7-(1-adamantyl)-1-cyclopropyl-2-sulfanylidene-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one
Openeye Name:7-(1-adamantyl)-1-cyclopropyl-2-thioxo-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one
CAS Name:7-(1-adamantyl)-1-cyclopropyl-2-sulfanylidene-5-(trifluoromethyl)-4-pyrido[2,3-d]pyrimidinone
IUPAC Name:7-(1-adamantyl)-1-cyclopropyl-2-sulfanylidene-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one
Traditional Name:7-(1-adamantyl)-1-cyclopropyl-2-thioxo-5-(trifluoromethyl)pyrido[2,3-d]pyrimidin-4-one
Formula: C21H22F3N3OS
MolecularWeight: 421.47909
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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C3=C(C(=CC(=N3)C45CC6CC(C4)CC(C6)C5)C(F)(F)F)C(=O)NC2=S


Isomeric SMILES

C1CC1N2C3=C(C(=CC(=N3)C45CC6CC(C4)CC(C6)C5)C(F)(F)F)C(=O)NC2=S


InChI

InChI=1S/C21H22F3N3OS/c22-21(23,24)14-6-15(20-7-10-3-11(8-20)5-12(4-10)9-20)25-17-16(14)18(28)26-19(29)27(17)13-1-2-13/h6,10-13H,1-5,7-9H2,(H,26,28,29)


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