3-[2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1,3-benzoxazol-2-one Openeye Name: 3-[2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1,3-benzoxazol-2-one CAS Name: 3-[2-[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]ethyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethyl]-1,3-benzoxazol-2-one Traditional Name: 3-[2-[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]ethyl]-1,3-benzoxazol-2-one Formula: C13H14N4O2S MolecularWeight: 290.34086

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1)SCCN2C3=CC=CC=C3OC2=O

Isomeric SMILES

CCC1=NC(=NN1)SCCN2C3=CC=CC=C3OC2=O

InChI

InChI=1S/C13H14N4O2S/c1-2-11-14-12(16-15-11)20-8-7-17-9-5-3-4-6-10(9)19-13(17)18/h3-6H,2,7-8H2,1H3,(H,14,15,16)