(Z)-3-(1,3-benzodioxol-5-yl)-N-[2-(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]prop-2-enamide

Systemtic Name: (Z)-3-(1,3-benzodioxol-5-yl)-N-[2-(4-oxidanylidene-6-phenyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-pyrazol-3-yl]prop-2-enamide Openeye Name: (Z)-3-(1,3-benzodioxol-5-yl)-N-[2-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]prop-2-enamide CAS Name: (Z)-3-(1,3-benzodioxol-5-yl)-N-[2-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)-5-thiophen-2-yl-3-pyrazolyl]-2-propenamide IUPAC Name: (Z)-3-(1,3-benzodioxol-5-yl)-N-[2-(4-oxo-6-phenyl-1H-pyrimidin-2-yl)-5-thiophen-2-ylpyrazol-3-yl]prop-2-enamide Traditional Name: (Z)-3-(1,3-benzodioxol-5-yl)-N-[2-(4-keto-6-phenyl-1H-pyrimidin-2-yl)-5-(2-thienyl)pyrazol-3-yl]acrylamide Formula: C27H19N5O4S MolecularWeight: 509.53586

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=CC(=O)NC3=CC(=NN3C4=NC(=O)C=C(N4)C5=CC=CC=C5)C6=CC=CS6

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C\C(=O)NC3=CC(=NN3C4=NC(=O)C=C(N4)C5=CC=CC=C5)C6=CC=CS6

InChI

InChI=1S/C27H19N5O4S/c33-25(11-9-17-8-10-21-22(13-17)36-16-35-21)29-24-14-20(23-7-4-12-37-23)31-32(24)27-28-19(15-26(34)30-27)18-5-2-1-3-6-18/h1-15H,16H2,(H,29,33)(H,28,30,34)/b11-9-