N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-2-oxidanylidene-2-thiophen-2-yl-ethanamide

Systemtic Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-2-oxidanylidene-2-thiophen-2-yl-ethanamide Openeye Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-2-oxo-2-(2-thienyl)acetamide CAS Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-4-pyrimidinyl]amino]ethyl]-2-oxo-2-thiophen-2-ylacetamide IUPAC Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenylpyrimidin-4-yl]amino]ethyl]-2-oxo-2-thiophen-2-ylacetamide Traditional Name: N-[2-[[6-(2-acetamidoethylamino)-2-phenyl-pyrimidin-4-yl]amino]ethyl]-2-keto-2-(2-thienyl)acetamide Formula: C22H24N6O3S MolecularWeight: 452.52936

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC1=NC(=NC(=C1)NCCNC(=O)C(=O)C2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

CC(=O)NCCNC1=NC(=NC(=C1)NCCNC(=O)C(=O)C2=CC=CS2)C3=CC=CC=C3

InChI

InChI=1S/C22H24N6O3S/c1-15(29)23-9-10-24-18-14-19(28-21(27-18)16-6-3-2-4-7-16)25-11-12-26-22(31)20(30)17-8-5-13-32-17/h2-8,13-14H,9-12H2,1H3,(H,23,29)(H,26,31)(H2,24,25,27,28)