5-chloranyl-2-[(4-fluorophenyl)methylsulfanyl]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-[(4-fluorophenyl)methylsulfanyl]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-[(4-fluorophenyl)methylsulfanyl]-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide CAS Name: 5-chloro-2-[(4-fluorophenyl)methylthio]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-[(4-fluorophenyl)methylsulfanyl]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-[(4-fluorobenzyl)thio]-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide Formula: C17H15ClFN5OS2 MolecularWeight: 423.915303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(S1)NC(=O)C2=NC(=NC=C2Cl)SCC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)C1=NN=C(S1)NC(=O)C2=NC(=NC=C2Cl)SCC3=CC=C(C=C3)F

InChI

InChI=1S/C17H15ClFN5OS2/c1-9(2)15-23-24-17(27-15)22-14(25)13-12(18)7-20-16(21-13)26-8-10-3-5-11(19)6-4-10/h3-7,9H,8H2,1-2H3,(H,22,24,25)