(E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]prop-2-enamide

Systemtic Name: (E)-3-(7-chloranyl-1,3-benzodioxol-5-yl)-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]prop-2-enamide Openeye Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]prop-2-enamide CAS Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-N-[[2-(1-pyrazolyl)-4-pyridinyl]methyl]-2-propenamide IUPAC Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]prop-2-enamide Traditional Name: (E)-3-(7-chloro-1,3-benzodioxol-5-yl)-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]acrylamide Formula: C19H15ClN4O3 MolecularWeight: 382.8004

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)C=CC(=O)NCC3=CC(=NC=C3)N4C=CC=N4)Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)/C=C/C(=O)NCC3=CC(=NC=C3)N4C=CC=N4)Cl

InChI

InChI=1S/C19H15ClN4O3/c20-15-8-13(9-16-19(15)27-12-26-16)2-3-18(25)22-11-14-4-6-21-17(10-14)24-7-1-5-23-24/h1-10H,11-12H2,(H,22,25)/b3-2+