3-methyl-1-phenyl-5-pyridin-2-ylsulfanyl-pyrazole-4-carbaldehyde

Systemtic Name: 3-methyl-1-phenyl-5-pyridin-2-ylsulfanyl-pyrazole-4-carbaldehyde Openeye Name: 3-methyl-1-phenyl-5-(2-pyridylsulfanyl)pyrazole-4-carbaldehyde CAS Name: 3-methyl-1-phenyl-5-(2-pyridinylthio)-4-pyrazolecarboxaldehyde IUPAC Name: 3-methyl-1-phenyl-5-pyridin-2-ylsulfanylpyrazole-4-carbaldehyde Traditional Name: 3-methyl-1-phenyl-5-(2-pyridylthio)pyrazole-4-carbaldehyde Formula: C16H13N3OS MolecularWeight: 295.35892

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=O)SC2=CC=CC=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C=O)SC2=CC=CC=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H13N3OS/c1-12-14(11-20)16(21-15-9-5-6-10-17-15)19(18-12)13-7-3-2-4-8-13/h2-11H,1H3