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

Systemtic Name: 4-[(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)methyl]-5-ethyl-thiophene-2-carbaldehyde Openeye Name: 4-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]-5-ethyl-thiophene-2-carbaldehyde CAS Name: 4-[(4-chloro-3,5-dimethyl-1-pyrazolyl)methyl]-5-ethyl-2-thiophenecarboxaldehyde IUPAC Name: 4-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]-5-ethylthiophene-2-carbaldehyde Traditional Name: 4-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]-5-ethyl-thiophene-2-carbaldehyde Formula: C13H15ClN2OS MolecularWeight: 282.789

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(S1)C=O)CN2C(=C(C(=N2)C)Cl)C

Isomeric SMILES

CCC1=C(C=C(S1)C=O)CN2C(=C(C(=N2)C)Cl)C

InChI

InChI=1S/C13H15ClN2OS/c1-4-12-10(5-11(7-17)18-12)6-16-9(3)13(14)8(2)15-16/h5,7H,4,6H2,1-3H3