2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-benzoxazole

Systemtic Name: 2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-benzoxazole Openeye Name: 2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-benzoxazole CAS Name: 2-[[(4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-1,3-benzoxazole IUPAC Name: 2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-benzoxazole Traditional Name: 2-[[(4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-1,3-benzoxazole Formula: C16H12N4OS MolecularWeight: 308.35768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=NN=C2SCC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1=CC=C(C=C1)N2C=NN=C2SCC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C16H12N4OS/c1-2-6-12(7-3-1)20-11-17-19-16(20)22-10-15-18-13-8-4-5-9-14(13)21-15/h1-9,11H,10H2