N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-5-chloranyl-1,3-dimethyl-pyrazole-4-carboxamide

Systemtic Name: N-[2-[(5-bromanylthiophen-2-yl)methylsulfanyl]ethyl]-5-chloranyl-1,3-dimethyl-pyrazole-4-carboxamide Openeye Name: N-[2-[(5-bromo-2-thienyl)methylsulfanyl]ethyl]-5-chloro-1,3-dimethyl-pyrazole-4-carboxamide CAS Name: N-[2-[(5-bromo-2-thiophenyl)methylthio]ethyl]-5-chloro-1,3-dimethyl-4-pyrazolecarboxamide IUPAC Name: N-[2-[(5-bromothiophen-2-yl)methylsulfanyl]ethyl]-5-chloro-1,3-dimethylpyrazole-4-carboxamide Traditional Name: N-[2-[(5-bromo-2-thienyl)methylthio]ethyl]-5-chloro-1,3-dimethyl-pyrazole-4-carboxamide Formula: C13H15BrClN3OS2 MolecularWeight: 408.7647

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)NCCSCC2=CC=C(S2)Br)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)NCCSCC2=CC=C(S2)Br)Cl)C

InChI

InChI=1S/C13H15BrClN3OS2/c1-8-11(12(15)18(2)17-8)13(19)16-5-6-20-7-9-3-4-10(14)21-9/h3-4H,5-7H2,1-2H3,(H,16,19)