N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-N',N'-bis(prop-2-enyl)ethanediamide

Systemtic Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-N',N'-bis(prop-2-enyl)ethanediamide Openeye Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-N',N'-diallyl-oxamide CAS Name: N-[6-(2-acetamidoethylamino)-2-phenyl-4-pyrimidinyl]-N',N'-bis(prop-2-enyl)oxamide IUPAC Name: N-[6-(2-acetamidoethylamino)-2-phenylpyrimidin-4-yl]-N',N'-bis(prop-2-enyl)oxamide Traditional Name: N-[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]-N',N'-diallyl-oxamide Formula: C22H26N6O3 MolecularWeight: 422.48024

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)NC(=O)C(=O)N(CC=C)CC=C)C2=CC=CC=C2

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)NC(=O)C(=O)N(CC=C)CC=C)C2=CC=CC=C2

InChI

InChI=1S/C22H26N6O3/c1-4-13-28(14-5-2)22(31)21(30)27-19-15-18(24-12-11-23-16(3)29)25-20(26-19)17-9-7-6-8-10-17/h4-10,15H,1-2,11-14H2,3H3,(H,23,29)(H2,24,25,26,27,30)