4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]sulfanyl]-3-nitro-benzaldehyde

Systemtic Name: 4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]sulfanyl]-3-nitro-benzaldehyde Openeye Name: 3-nitro-4-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]sulfanyl]benzaldehyde CAS Name: 4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]thio]-3-nitrobenzaldehyde IUPAC Name: 4-[[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]sulfanyl]-3-nitrobenzaldehyde Traditional Name: 3-nitro-4-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]thio]benzaldehyde Formula: C16H11N3O4S MolecularWeight: 341.34124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)SC3=C(C=C(C=C3)C=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)SC3=C(C=C(C=C3)C=O)[N+](=O)[O-]

InChI

InChI=1S/C16H11N3O4S/c1-10-2-5-12(6-3-10)15-17-16(23-18-15)24-14-7-4-11(9-20)8-13(14)19(21)22/h2-9H,1H3