5-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-1,2-oxazole

Systemtic Name: 5-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-1,2-oxazole Openeye Name: 5-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-isoxazole CAS Name: 5-[(1H-benzimidazol-2-ylthio)methyl]-3-methylisoxazole IUPAC Name: 5-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-1,2-oxazole Traditional Name: 5-[(1H-benzimidazol-2-ylthio)methyl]-3-methyl-isoxazole Formula: C12H11N3OS MolecularWeight: 245.30024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

CC1=NOC(=C1)CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C12H11N3OS/c1-8-6-9(16-15-8)7-17-12-13-10-4-2-3-5-11(10)14-12/h2-6H,7H2,1H3,(H,13,14)