(E)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-enamide CAS Name: (E)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]-2-propenamide IUPAC Name: (E)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]acrylamide Formula: C26H22N4O3 MolecularWeight: 438.47788

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)C=CC3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)/C=C/C3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5)OC1

InChI

InChI=1S/C26H22N4O3/c31-25(28-21-10-11-23-24(16-21)33-15-5-14-32-23)12-9-20-18-30(22-7-2-1-3-8-22)29-26(20)19-6-4-13-27-17-19/h1-4,6-13,16-18H,5,14-15H2,(H,28,31)/b12-9+