N-(4-fluoranyl-3-nitro-phenyl)-2-[(3-methyl-1,2-oxazol-5-yl)methylsulfanyl]benzamide

Systemtic Name: N-(4-fluoranyl-3-nitro-phenyl)-2-[(3-methyl-1,2-oxazol-5-yl)methylsulfanyl]benzamide Openeye Name: N-(4-fluoro-3-nitro-phenyl)-2-[(3-methylisoxazol-5-yl)methylsulfanyl]benzamide CAS Name: N-(4-fluoro-3-nitrophenyl)-2-[(3-methyl-5-isoxazolyl)methylthio]benzamide IUPAC Name: N-(4-fluoro-3-nitrophenyl)-2-[(3-methyl-1,2-oxazol-5-yl)methylsulfanyl]benzamide Traditional Name: N-(4-fluoro-3-nitro-phenyl)-2-[(3-methylisoxazol-5-yl)methylthio]benzamide Formula: C18H14FN3O4S MolecularWeight: 387.384863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CSC2=CC=CC=C2C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=NOC(=C1)CSC2=CC=CC=C2C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C18H14FN3O4S/c1-11-8-13(26-21-11)10-27-17-5-3-2-4-14(17)18(23)20-12-6-7-15(19)16(9-12)22(24)25/h2-9H,10H2,1H3,(H,20,23)