N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(3-nitrophenyl)-1-phenyl-imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(3-nitrophenyl)-1-phenyl-imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-[4-(3-nitrophenyl)-1-phenyl-imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[[4-(3-nitrophenyl)-1-phenyl-2-imidazolyl]thio]acetamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[4-(3-nitrophenyl)-1-phenylimidazol-2-yl]sulfanylacetamide Traditional Name: N-(5-methylisoxazol-3-yl)-2-[[4-(3-nitrophenyl)-1-phenyl-imidazol-2-yl]thio]acetamide Formula: C21H17N5O4S MolecularWeight: 435.45578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17N5O4S/c1-14-10-19(24-30-14)23-20(27)13-31-21-22-18(12-25(21)16-7-3-2-4-8-16)15-6-5-9-17(11-15)26(28)29/h2-12H,13H2,1H3,(H,23,24,27)