(E)-3-(1,3-diphenylpyrazol-4-yl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]prop-2-enamide

Systemtic Name: (E)-3-(1,3-diphenylpyrazol-4-yl)-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]prop-2-enamide Openeye Name: (E)-3-(1,3-diphenylpyrazol-4-yl)-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]prop-2-enamide CAS Name: (E)-3-(1,3-diphenyl-4-pyrazolyl)-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-2-propenamide IUPAC Name: (E)-3-(1,3-diphenylpyrazol-4-yl)-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]prop-2-enamide Traditional Name: (E)-3-(1,3-diphenylpyrazol-4-yl)-N-[6-(3-ketopiperazino)-3-pyridyl]acrylamide Formula: C27H24N6O2 MolecularWeight: 464.51846

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)C=CC3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)/C=C/C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H24N6O2/c34-25(30-22-12-13-24(29-17-22)32-16-15-28-26(35)19-32)14-11-21-18-33(23-9-5-2-6-10-23)31-27(21)20-7-3-1-4-8-20/h1-14,17-18H,15-16,19H2,(H,28,35)(H,30,34)/b14-11+