5-bromanyl-2-[(2-methylphenyl)methylsulfanyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide

Systemtic Name: 5-bromanyl-2-[(2-methylphenyl)methylsulfanyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide Openeye Name: 5-bromo-N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-(o-tolylmethylsulfanyl)pyrimidine-4-carboxamide CAS Name: 5-bromo-2-[(2-methylphenyl)methylthio]-N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-pyrimidinecarboxamide IUPAC Name: 5-bromo-2-[(2-methylphenyl)methylsulfanyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide Traditional Name: 5-bromo-2-[(2-methylbenzyl)thio]-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide Formula: C16H14BrN5OS2 MolecularWeight: 436.34926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC=C(C(=N2)C(=O)NC3=NN=C(S3)C)Br

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC=C(C(=N2)C(=O)NC3=NN=C(S3)C)Br

InChI

InChI=1S/C16H14BrN5OS2/c1-9-5-3-4-6-11(9)8-24-15-18-7-12(17)13(19-15)14(23)20-16-22-21-10(2)25-16/h3-7H,8H2,1-2H3,(H,20,22,23)