1-(3-phenyl-1-thiophen-2-yl-pyrazol-4-yl)-N-(1,2,4-triazol-4-yl)methanimine

Systemtic Name: 1-(3-phenyl-1-thiophen-2-yl-pyrazol-4-yl)-N-(1,2,4-triazol-4-yl)methanimine Openeye Name: 1-[3-phenyl-1-(2-thienyl)pyrazol-4-yl]-N-(1,2,4-triazol-4-yl)methanimine CAS Name: 1-(3-phenyl-1-thiophen-2-yl-4-pyrazolyl)-N-(1,2,4-triazol-4-yl)methanimine IUPAC Name: 1-(3-phenyl-1-thiophen-2-ylpyrazol-4-yl)-N-(1,2,4-triazol-4-yl)methanimine Traditional Name: (E)-[3-phenyl-1-(2-thienyl)pyrazol-4-yl]methylene-(1,2,4-triazol-4-yl)amine Formula: C16H12N6S MolecularWeight: 320.37168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=NN3C=NN=C3)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2/C=N/N3C=NN=C3)C4=CC=CS4

InChI

InChI=1S/C16H12N6S/c1-2-5-13(6-3-1)16-14(9-19-21-11-17-18-12-21)10-22(20-16)15-7-4-8-23-15/h1-12H/b19-9+