2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-thiophen-2-yl-ethanone

Systemtic Name: 2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-thiophen-2-yl-ethanone Openeye Name: 2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-thienyl)ethanone CAS Name: 2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)thio]-1-thiophen-2-ylethanone IUPAC Name: 2-[(5-propan-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-thiophen-2-ylethanone Traditional Name: 2-[(5-isopropyl-1H-1,2,4-triazol-3-yl)thio]-1-(2-thienyl)ethanone Formula: C11H13N3OS2 MolecularWeight: 267.37042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=NN1)SCC(=O)C2=CC=CS2

Isomeric SMILES

CC(C)C1=NC(=NN1)SCC(=O)C2=CC=CS2

InChI

InChI=1S/C11H13N3OS2/c1-7(2)10-12-11(14-13-10)17-6-8(15)9-4-3-5-16-9/h3-5,7H,6H2,1-2H3,(H,12,13,14)