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

Systemtic Name: 4-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-3-nitro-benzaldehyde Openeye Name: 4-(1-methyltetrazol-5-yl)sulfanyl-3-nitro-benzaldehyde CAS Name: 4-[(1-methyl-5-tetrazolyl)thio]-3-nitrobenzaldehyde IUPAC Name: 4-(1-methyltetrazol-5-yl)sulfanyl-3-nitrobenzaldehyde Traditional Name: 4-[(1-methyltetrazol-5-yl)thio]-3-nitro-benzaldehyde Formula: C9H7N5O3S MolecularWeight: 265.24858

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SC2=C(C=C(C=C2)C=O)[N+](=O)[O-]

Isomeric SMILES

CN1C(=NN=N1)SC2=C(C=C(C=C2)C=O)[N+](=O)[O-]

InChI

InChI=1S/C9H7N5O3S/c1-13-9(10-11-12-13)18-8-3-2-6(5-15)4-7(8)14(16)17/h2-5H,1H3