(E)-3-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]-N-pyridin-3-yl-prop-2-enamide

Systemtic Name: (E)-3-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]-N-pyridin-3-yl-prop-2-enamide Openeye Name: (E)-3-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]-N-(3-pyridyl)prop-2-enamide CAS Name: (E)-3-[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]-N-(3-pyridinyl)-2-propenamide IUPAC Name: (E)-3-(1-benzyl-3-thiophen-2-ylpyrazol-4-yl)-N-pyridin-3-ylprop-2-enamide Traditional Name: (E)-3-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]-N-(3-pyridyl)acrylamide Formula: C22H18N4OS MolecularWeight: 386.46952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)C=CC(=O)NC4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)/C=C/C(=O)NC4=CN=CC=C4

InChI

InChI=1S/C22H18N4OS/c27-21(24-19-8-4-12-23-14-19)11-10-18-16-26(15-17-6-2-1-3-7-17)25-22(18)20-9-5-13-28-20/h1-14,16H,15H2,(H,24,27)/b11-10+