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

Systemtic Name: (E)-N-(4-acetamido-3-chloranyl-phenyl)-3-[1-(phenylmethyl)-3-pyridin-3-yl-pyrazol-4-yl]prop-2-enamide Openeye Name: (E)-N-(4-acetamido-3-chloro-phenyl)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-enamide CAS Name: (E)-N-(4-acetamido-3-chlorophenyl)-3-[1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-N-(4-acetamido-3-chlorophenyl)-3-(1-benzyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-(4-acetamido-3-chloro-phenyl)-3-[1-benzyl-3-(3-pyridyl)pyrazol-4-yl]acrylamide Formula: C26H22ClN5O2 MolecularWeight: 471.93818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)NC(=O)C=CC2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4)Cl

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)NC(=O)/C=C/C2=CN(N=C2C3=CN=CC=C3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C26H22ClN5O2/c1-18(33)29-24-11-10-22(14-23(24)27)30-25(34)12-9-21-17-32(16-19-6-3-2-4-7-19)31-26(21)20-8-5-13-28-15-20/h2-15,17H,16H2,1H3,(H,29,33)(H,30,34)/b12-9+