4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-5-methyl-thiophene-2-carbaldehyde

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-5-methyl-thiophene-2-carbaldehyde Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-5-methyl-thiophene-2-carbaldehyde CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-5-methyl-2-thiophenecarboxaldehyde IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-5-methylthiophene-2-carbaldehyde Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-5-methyl-thiophene-2-carbaldehyde Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(SC(=C2)C=O)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=C(SC(=C2)C=O)C)C)[N+](=O)[O-]

InChI

InChI=1S/C12H13N3O3S/c1-7-12(15(17)18)8(2)14(13-7)5-10-4-11(6-16)19-9(10)3/h4,6H,5H2,1-3H3