2-[5-(1,3-benzoxazol-2-ylsulfanyl)-1,2,4-triazol-1-yl]-1,3-benzoxazole

Systemtic Name: 2-[5-(1,3-benzoxazol-2-ylsulfanyl)-1,2,4-triazol-1-yl]-1,3-benzoxazole Openeye Name: 2-[5-(1,3-benzoxazol-2-ylsulfanyl)-1,2,4-triazol-1-yl]-1,3-benzoxazole CAS Name: 2-[5-(1,3-benzoxazol-2-ylthio)-1,2,4-triazol-1-yl]-1,3-benzoxazole IUPAC Name: 2-[5-(1,3-benzoxazol-2-ylsulfanyl)-1,2,4-triazol-1-yl]-1,3-benzoxazole Traditional Name: 2-[5-(1,3-benzoxazol-2-ylthio)-1,2,4-triazol-1-yl]-1,3-benzoxazole Formula: C16H9N5O2S MolecularWeight: 335.33996

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)N3C(=NC=N3)SC4=NC5=CC=CC=C5O4

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)N3C(=NC=N3)SC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C16H9N5O2S/c1-3-7-12-10(5-1)19-14(22-12)21-15(17-9-18-21)24-16-20-11-6-2-4-8-13(11)23-16/h1-9H