5-chloranyl-2-ethylsulfonyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-ethylsulfonyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-ethylsulfonyl-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide CAS Name: 5-chloro-2-ethylsulfonyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-ethylsulfonyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-esyl-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide Formula: C13H16ClN5O3S2 MolecularWeight: 389.88084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=NN=C(S2)CC(C)C)Cl

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=NN=C(S2)CC(C)C)Cl

InChI

InChI=1S/C13H16ClN5O3S2/c1-4-24(21,22)13-15-6-8(14)10(16-13)11(20)17-12-19-18-9(23-12)5-7(2)3/h6-7H,4-5H2,1-3H3,(H,17,19,20)