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

Systemtic Name: 2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-5-nitro-benzaldehyde Openeye Name: 2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-5-nitro-benzaldehyde CAS Name: 2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-5-nitrobenzaldehyde IUPAC Name: 2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]-5-nitrobenzaldehyde Traditional Name: 2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-5-nitro-benzaldehyde Formula: C10H8N4O3S MolecularWeight: 264.26052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1)SC2=C(C=C(C=C2)[N+](=O)[O-])C=O

Isomeric SMILES

CC1=NC(=NN1)SC2=C(C=C(C=C2)[N+](=O)[O-])C=O

InChI

InChI=1S/C10H8N4O3S/c1-6-11-10(13-12-6)18-9-3-2-8(14(16)17)4-7(9)5-15/h2-5H,1H3,(H,11,12,13)