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

Systemtic Name: (E)-N-(4-acetamidophenyl)-3-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-N-(4-acetamidophenyl)-3-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]prop-2-enamide CAS Name: (E)-N-(4-acetamidophenyl)-3-[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-N-(4-acetamidophenyl)-3-(1-benzyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-(4-acetamidophenyl)-3-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]acrylamide Formula: C25H22N4O2S MolecularWeight: 442.53278

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C=CC2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)/C=C/C2=CN(N=C2C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C25H22N4O2S/c1-18(30)26-21-10-12-22(13-11-21)27-24(31)14-9-20-17-29(16-19-6-3-2-4-7-19)28-25(20)23-8-5-15-32-23/h2-15,17H,16H2,1H3,(H,26,30)(H,27,31)/b14-9+