N-[(Z)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]-2-methylsulfanyl-aniline

Systemtic Name: N-[(Z)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]-2-methylsulfanyl-aniline Openeye Name: N-[(Z)-2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]-2-methylsulfanyl-aniline CAS Name: N-[(Z)-2-(3-methyl-4-nitro-5-isoxazolyl)ethenyl]-2-(methylthio)aniline IUPAC Name: N-[(Z)-2-(3-methyl-4-nitro-1,2-oxazol-5-yl)ethenyl]-2-methylsulfanylaniline Traditional Name: [(Z)-2-(3-methyl-4-nitro-isoxazol-5-yl)vinyl]-[2-(methylthio)phenyl]amine Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1[N+](=O)[O-])C=CNC2=CC=CC=C2SC

Isomeric SMILES

CC1=NOC(=C1[N+](=O)[O-])/C=C\NC2=CC=CC=C2SC

InChI

InChI=1S/C13H13N3O3S/c1-9-13(16(17)18)11(19-15-9)7-8-14-10-5-3-4-6-12(10)20-2/h3-8,14H,1-2H3/b8-7-