(E)-N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-3-thiophen-3-yl-prop-2-enamide

Systemtic Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-3-thiophen-3-yl-prop-2-enamide Openeye Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-3-(3-thienyl)prop-2-enamide CAS Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-4-pyrimidinyl]amino]ethyl]-3-(3-thiophenyl)-2-propenamide IUPAC Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenylpyrimidin-4-yl]amino]ethyl]-3-thiophen-3-ylprop-2-enamide Traditional Name: (E)-N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-3-(3-thienyl)acrylamide Formula: C24H28N6O2S MolecularWeight: 464.58312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1NCCNC(=O)C)C2=CC=CC=C2)NCCNC(=O)C=CC3=CSC=C3

Isomeric SMILES

CC1=C(N=C(N=C1NCCNC(=O)C)C2=CC=CC=C2)NCCNC(=O)/C=C/C3=CSC=C3

InChI

InChI=1S/C24H28N6O2S/c1-17-22(27-13-11-25-18(2)31)29-24(20-6-4-3-5-7-20)30-23(17)28-14-12-26-21(32)9-8-19-10-15-33-16-19/h3-10,15-16H,11-14H2,1-2H3,(H,25,31)(H,26,32)(H2,27,28,29,30)/b9-8+