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

Systemtic Name: (E)-3-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]-N-(pyridin-3-ylmethyl)prop-2-enamide Openeye Name: (E)-3-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]-N-(3-pyridylmethyl)prop-2-enamide CAS Name: (E)-3-[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]-N-(3-pyridinylmethyl)-2-propenamide IUPAC Name: (E)-3-(1-benzyl-3-thiophen-2-ylpyrazol-4-yl)-N-(pyridin-3-ylmethyl)prop-2-enamide Traditional Name: (E)-3-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]-N-(3-pyridylmethyl)acrylamide Formula: C23H20N4OS MolecularWeight: 400.4961

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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)NCC4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CS3)/C=C/C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C23H20N4OS/c28-22(25-15-19-8-4-12-24-14-19)11-10-20-17-27(16-18-6-2-1-3-7-18)26-23(20)21-9-5-13-29-21/h1-14,17H,15-16H2,(H,25,28)/b11-10+