2-(1H-1,2,4-triazol-5-ylsulfanyl)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone

Systemtic Name: 2-(1H-1,2,4-triazol-5-ylsulfanyl)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Openeye Name: 2-(1H-1,2,4-triazol-5-ylsulfanyl)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone CAS Name: 2-(1H-1,2,4-triazol-5-ylthio)-1-(1,2,5-trimethyl-3-pyrrolyl)ethanone IUPAC Name: 2-(1H-1,2,4-triazol-5-ylsulfanyl)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Traditional Name: 2-(1H-1,2,4-triazol-5-ylthio)-1-(1,2,5-trimethylpyrrol-3-yl)ethanone Formula: C11H14N4OS MolecularWeight: 250.32006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)CSC2=NC=NN2

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)CSC2=NC=NN2

InChI

InChI=1S/C11H14N4OS/c1-7-4-9(8(2)15(7)3)10(16)5-17-11-12-6-13-14-11/h4,6H,5H2,1-3H3,(H,12,13,14)