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

Systemtic Name: 5-chloranyl-2-ethylsulfanyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]pyrimidine-4-carboxamide Openeye Name: 5-chloro-2-ethylsulfanyl-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide CAS Name: 5-chloro-2-(ethylthio)-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-ethylsulfanyl-N-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]pyrimidine-4-carboxamide Traditional Name: 5-chloro-2-(ethylthio)-N-(5-isobutyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide Formula: C13H16ClN5OS2 MolecularWeight: 357.88204

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC=C(C(=N1)C(=O)NC2=NN=C(S2)CC(C)C)Cl

Isomeric SMILES

CCSC1=NC=C(C(=N1)C(=O)NC2=NN=C(S2)CC(C)C)Cl

InChI

InChI=1S/C13H16ClN5OS2/c1-4-21-12-15-6-8(14)10(16-12)11(20)17-13-19-18-9(22-13)5-7(2)3/h6-7H,4-5H2,1-3H3,(H,17,19,20)