3-(4-bromanyl-3-methyl-phenyl)sulfanyl-N,N-diethyl-pyrazole-1-carboxamide

Systemtic Name: 3-(4-bromanyl-3-methyl-phenyl)sulfanyl-N,N-diethyl-pyrazole-1-carboxamide Openeye Name: 3-(4-bromo-3-methyl-phenyl)sulfanyl-N,N-diethyl-pyrazole-1-carboxamide CAS Name: 3-[(4-bromo-3-methylphenyl)thio]-N,N-diethyl-1-pyrazolecarboxamide IUPAC Name: 3-(4-bromo-3-methylphenyl)sulfanyl-N,N-diethylpyrazole-1-carboxamide Traditional Name: 3-[(4-bromo-3-methyl-phenyl)thio]-N,N-diethyl-pyrazole-1-carboxamide Formula: C15H18BrN3OS MolecularWeight: 368.29192

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1C=CC(=N1)SC2=CC(=C(C=C2)Br)C

Isomeric SMILES

CCN(CC)C(=O)N1C=CC(=N1)SC2=CC(=C(C=C2)Br)C

InChI

InChI=1S/C15H18BrN3OS/c1-4-18(5-2)15(20)19-9-8-14(17-19)21-12-6-7-13(16)11(3)10-12/h6-10H,4-5H2,1-3H3