5-chloranyl-2-ethylsulfonyl-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-2-ethylsulfonyl-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide Openeye Name: N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-5-chloro-2-ethylsulfonyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-2-ethylsulfonyl-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-2-ethylsulfonyl-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide Traditional Name: N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-5-chloro-2-esyl-pyrimidine-4-carboxamide Formula: C12H12ClN5O3S3 MolecularWeight: 405.90338

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12ClN5O3S3/c1-3-5-22-12-18-17-10(23-12)16-9(19)8-7(13)6-14-11(15-8)24(20,21)4-2/h3,6H,1,4-5H2,2H3,(H,16,17,19)