(E)-N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-3-thiophen-3-yl-prop-2-enamide

Systemtic Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-3-thiophen-3-yl-prop-2-enamide Openeye Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-3-(3-thienyl)prop-2-enamide CAS Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-4-pyrimidinyl]amino]ethyl]-3-(3-thiophenyl)-2-propenamide IUPAC Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-2-phenylpyrimidin-4-yl]amino]ethyl]-3-thiophen-3-ylprop-2-enamide Traditional Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-3-(3-thienyl)acrylamide Formula: C23H26N6O2S MolecularWeight: 450.55654

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)NCCNC(=O)C=CC2=CSC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)NCCNC(=O)/C=C/C2=CSC=C2)C3=CC=CC=C3

InChI

InChI=1S/C23H26N6O2S/c1-17(30)24-10-11-25-20-15-21(29-23(28-20)19-5-3-2-4-6-19)26-12-13-27-22(31)8-7-18-9-14-32-16-18/h2-9,14-16H,10-13H2,1H3,(H,24,30)(H,27,31)(H2,25,26,28,29)/b8-7+