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

Systemtic Name: 4-[[1-(2-methylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-3-nitro-benzaldehyde Openeye Name: 3-nitro-4-[1-(o-tolyl)tetrazol-5-yl]sulfanyl-benzaldehyde CAS Name: 4-[[1-(2-methylphenyl)-5-tetrazolyl]thio]-3-nitrobenzaldehyde IUPAC Name: 4-[1-(2-methylphenyl)tetrazol-5-yl]sulfanyl-3-nitrobenzaldehyde Traditional Name: 3-nitro-4-[[1-(o-tolyl)tetrazol-5-yl]thio]benzaldehyde Formula: C15H11N5O3S MolecularWeight: 341.34454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NN=N2)SC3=C(C=C(C=C3)C=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2C(=NN=N2)SC3=C(C=C(C=C3)C=O)[N+](=O)[O-]

InChI

InChI=1S/C15H11N5O3S/c1-10-4-2-3-5-12(10)19-15(16-17-18-19)24-14-7-6-11(9-21)8-13(14)20(22)23/h2-9H,1H3