4-[[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanylmethyl]-3,5-dimethyl-1,2-oxazole

Systemtic Name: 4-[[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanylmethyl]-3,5-dimethyl-1,2-oxazole Openeye Name: 4-[[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]sulfanylmethyl]-3,5-dimethyl-isoxazole CAS Name: 4-[[[1-(2-methoxyphenyl)-5-nitro-2-benzimidazolyl]thio]methyl]-3,5-dimethylisoxazole IUPAC Name: 4-[[1-(2-methoxyphenyl)-5-nitrobenzimidazol-2-yl]sulfanylmethyl]-3,5-dimethyl-1,2-oxazole Traditional Name: 4-[[[1-(2-methoxyphenyl)-5-nitro-benzimidazol-2-yl]thio]methyl]-3,5-dimethyl-isoxazole Formula: C20H18N4O4S MolecularWeight: 410.44632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=NC3=C(N2C4=CC=CC=C4OC)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=NC3=C(N2C4=CC=CC=C4OC)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N4O4S/c1-12-15(13(2)28-22-12)11-29-20-21-16-10-14(24(25)26)8-9-17(16)23(20)18-6-4-5-7-19(18)27-3/h4-10H,11H2,1-3H3