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

Systemtic Name: 5-bromanyl-2-[(4-fluorophenyl)methylsulfonyl]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide Openeye Name: 5-bromo-2-[(4-fluorophenyl)methylsulfonyl]-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide CAS Name: 5-bromo-2-[(4-fluorophenyl)methylsulfonyl]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-4-pyrimidinecarboxamide IUPAC Name: 5-bromo-2-[(4-fluorophenyl)methylsulfonyl]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide Traditional Name: 5-bromo-2-(4-fluorobenzyl)sulfonyl-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide Formula: C17H15BrFN5O3S2 MolecularWeight: 500.365103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(S1)NC(=O)C2=NC(=NC=C2Br)S(=O)(=O)CC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)C1=NN=C(S1)NC(=O)C2=NC(=NC=C2Br)S(=O)(=O)CC3=CC=C(C=C3)F

InChI

InChI=1S/C17H15BrFN5O3S2/c1-9(2)15-23-24-16(28-15)22-14(25)13-12(18)7-20-17(21-13)29(26,27)8-10-3-5-11(19)6-4-10/h3-7,9H,8H2,1-2H3,(H,22,24,25)