3-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylsulfanylmethyl)-5-methyl-1,2-oxazole

Systemtic Name: 3-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylsulfanylmethyl)-5-methyl-1,2-oxazole Openeye Name: 3-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylsulfanylmethyl)-5-methyl-isoxazole CAS Name: 3-[(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylthio)methyl]-5-methylisoxazole IUPAC Name: 3-(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylsulfanylmethyl)-5-methyl-1,2-oxazole Traditional Name: 3-[(3a,4,5,6,7,7a-hexahydro-1H-benzimidazol-2-ylthio)methyl]-5-methyl-isoxazole Formula: C12H17N3OS MolecularWeight: 251.34788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CSC2=NC3CCCCC3N2

Isomeric SMILES

CC1=CC(=NO1)CSC2=NC3CCCCC3N2

InChI

InChI=1S/C12H17N3OS/c1-8-6-9(15-16-8)7-17-12-13-10-4-2-3-5-11(10)14-12/h6,10-11H,2-5,7H2,1H3,(H,13,14)