3,5-dimethyl-4-[[4-(3-nitrophenyl)-1-phenyl-imidazol-2-yl]sulfanylmethyl]-1,2-oxazole

Systemtic Name: 3,5-dimethyl-4-[[4-(3-nitrophenyl)-1-phenyl-imidazol-2-yl]sulfanylmethyl]-1,2-oxazole Openeye Name: 3,5-dimethyl-4-[[4-(3-nitrophenyl)-1-phenyl-imidazol-2-yl]sulfanylmethyl]isoxazole CAS Name: 3,5-dimethyl-4-[[[4-(3-nitrophenyl)-1-phenyl-2-imidazolyl]thio]methyl]isoxazole IUPAC Name: 3,5-dimethyl-4-[[4-(3-nitrophenyl)-1-phenylimidazol-2-yl]sulfanylmethyl]-1,2-oxazole Traditional Name: 3,5-dimethyl-4-[[[4-(3-nitrophenyl)-1-phenyl-imidazol-2-yl]thio]methyl]isoxazole Formula: C21H18N4O3S MolecularWeight: 406.45762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=NC(=CN2C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=NC(=CN2C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H18N4O3S/c1-14-19(15(2)28-23-14)13-29-21-22-20(12-24(21)17-8-4-3-5-9-17)16-7-6-10-18(11-16)25(26)27/h3-12H,13H2,1-2H3