3-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-pyrazole-4-carbaldehyde

Systemtic Name: 3-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-pyrazole-4-carbaldehyde Openeye Name: 3-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenyl-pyrazole-4-carbaldehyde CAS Name: 3-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-phenyl-4-pyrazolecarboxaldehyde IUPAC Name: 3-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-1-phenylpyrazole-4-carbaldehyde Traditional Name: 3-methyl-5-[(4-methyl-1,2,4-triazol-3-yl)thio]-1-phenyl-pyrazole-4-carbaldehyde Formula: C14H13N5OS MolecularWeight: 299.35092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=O)SC2=NN=CN2C)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C=O)SC2=NN=CN2C)C3=CC=CC=C3

InChI

InChI=1S/C14H13N5OS/c1-10-12(8-20)13(21-14-16-15-9-18(14)2)19(17-10)11-6-4-3-5-7-11/h3-9H,1-2H3