2-tert-butyl-N-[5-[(3-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]pyrimidine-5-carboxamide

Systemtic Name: 2-tert-butyl-N-[5-[(3-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]pyrimidine-5-carboxamide Openeye Name: 2-tert-butyl-N-[5-[(3-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]pyrimidine-5-carboxamide CAS Name: 2-tert-butyl-N-[5-[(3-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]-5-pyrimidinecarboxamide IUPAC Name: 2-tert-butyl-N-[5-[(3-fluorophenyl)methyl]-1,3,4-thiadiazol-2-yl]pyrimidine-5-carboxamide Traditional Name: 2-tert-butyl-N-[5-(3-fluorobenzyl)-1,3,4-thiadiazol-2-yl]pyrimidine-5-carboxamide Formula: C18H18FN5OS MolecularWeight: 371.431823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC=C(C=N1)C(=O)NC2=NN=C(S2)CC3=CC(=CC=C3)F

Isomeric SMILES

CC(C)(C)C1=NC=C(C=N1)C(=O)NC2=NN=C(S2)CC3=CC(=CC=C3)F

InChI

InChI=1S/C18H18FN5OS/c1-18(2,3)16-20-9-12(10-21-16)15(25)22-17-24-23-14(26-17)8-11-5-4-6-13(19)7-11/h4-7,9-10H,8H2,1-3H3,(H,22,24,25)