5-chloranyl-N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-propylsulfonyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-propylsulfonyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[5-(1-naphthylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-propylsulfonyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[5-(1-naphthalenylmethylthio)-1,3,4-thiadiazol-2-yl]-2-propylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-propylsulfonylpyrimidine-4-carboxamide Traditional Name: 5-chloro-N-[5-(1-naphthylmethylthio)-1,3,4-thiadiazol-2-yl]-2-propylsulfonyl-pyrimidine-4-carboxamide Formula: C21H18ClN5O3S3 MolecularWeight: 520.04732

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=NN=C(S2)SCC3=CC=CC4=CC=CC=C43)Cl

Isomeric SMILES

CCCS(=O)(=O)C1=NC=C(C(=N1)C(=O)NC2=NN=C(S2)SCC3=CC=CC4=CC=CC=C43)Cl

InChI

InChI=1S/C21H18ClN5O3S3/c1-2-10-33(29,30)20-23-11-16(22)17(24-20)18(28)25-19-26-27-21(32-19)31-12-14-8-5-7-13-6-3-4-9-15(13)14/h3-9,11H,2,10,12H2,1H3,(H,25,26,28)