(E)-3-(3,4-dimethoxyphenyl)-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(3,4-dimethoxyphenyl)-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]prop-2-enamide Openeye Name: (E)-3-(3,4-dimethoxyphenyl)-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]prop-2-enamide CAS Name: (E)-3-(3,4-dimethoxyphenyl)-N-[3-[6-(1-pyrrolidinyl)-3-pyridazinyl]phenyl]-2-propenamide IUPAC Name: (E)-3-(3,4-dimethoxyphenyl)-N-[3-(6-pyrrolidin-1-ylpyridazin-3-yl)phenyl]prop-2-enamide Traditional Name: (E)-3-(3,4-dimethoxyphenyl)-N-[3-(6-pyrrolidinopyridazin-3-yl)phenyl]acrylamide Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCC4)OC

InChI

InChI=1S/C25H26N4O3/c1-31-22-11-8-18(16-23(22)32-2)9-13-25(30)26-20-7-5-6-19(17-20)21-10-12-24(28-27-21)29-14-3-4-15-29/h5-13,16-17H,3-4,14-15H2,1-2H3,(H,26,30)/b13-9+