N-[4-(cyanomethyl)phenyl]-1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-1-phenyl-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: N-[4-(cyanomethyl)phenyl]-1-phenyl-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: N-[4-(cyanomethyl)phenyl]-1-phenyl-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-1-phenyl-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: N-[4-(cyanomethyl)phenyl]-1-phenyl-3-(2-thienyl)pyrazole-4-carboxamide Formula: C22H16N4OS MolecularWeight: 384.45364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C(=O)NC4=CC=C(C=C4)CC#N

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C(=O)NC4=CC=C(C=C4)CC#N

InChI

InChI=1S/C22H16N4OS/c23-13-12-16-8-10-17(11-9-16)24-22(27)19-15-26(18-5-2-1-3-6-18)25-21(19)20-7-4-14-28-20/h1-11,14-15H,12H2,(H,24,27)