(2E,4E)-N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)pyrimidin-4-yl]amino]ethyl]-5-phenyl-penta-2,4-dienamide

Systemtic Name: (2E,4E)-N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)pyrimidin-4-yl]amino]ethyl]-5-phenyl-penta-2,4-dienamide Openeye Name: (2E,4E)-N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)pyrimidin-4-yl]amino]ethyl]-5-phenyl-penta-2,4-dienamide CAS Name: (2E,4E)-N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)-4-pyrimidinyl]amino]ethyl]-5-phenylpenta-2,4-dienamide IUPAC Name: (2E,4E)-N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)pyrimidin-4-yl]amino]ethyl]-5-phenylpenta-2,4-dienamide Traditional Name: (2E,4E)-N-[2-[[6-(2-acetamidoethylamino)-2-(4-chlorophenyl)pyrimidin-4-yl]amino]ethyl]-5-phenyl-penta-2,4-dienamide Formula: C27H29ClN6O2 MolecularWeight: 505.01116

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29ClN6O2/c1-20(35)29-15-16-30-24-19-25(34-27(33-24)22-11-13-23(28)14-12-22)31-17-18-32-26(36)10-6-5-9-21-7-3-2-4-8-21/h2-14,19H,15-18H2,1H3,(H,29,35)(H,32,36)(H2,30,31,33,34)/b9-5+,10-6+