N-[1-(dimethylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]-3-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-oxirane-2-carboxamide

Systemtic Name: N-[1-(dimethylamino)-1-oxidanylidene-3-phenyl-propan-2-yl]-3-(4-pyrimidin-2-ylpiperazin-1-yl)carbonyl-oxirane-2-carboxamide Openeye Name: N-[1-benzyl-2-(dimethylamino)-2-oxo-ethyl]-3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)oxirane-2-carboxamide CAS Name: N-[1-(dimethylamino)-1-oxo-3-phenylpropan-2-yl]-3-[oxo-[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-2-oxiranecarboxamide IUPAC Name: N-[1-(dimethylamino)-1-oxo-3-phenylpropan-2-yl]-3-(4-pyrimidin-2-ylpiperazine-1-carbonyl)oxirane-2-carboxamide Traditional Name: N-[1-benzyl-2-(dimethylamino)-2-keto-ethyl]-3-[4-(2-pyrimidyl)piperazine-1-carbonyl]oxirane-2-carboxamide Formula: C23H28N6O4 MolecularWeight: 452.50622

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C(CC1=CC=CC=C1)NC(=O)C2C(O2)C(=O)N3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CN(C)C(=O)C(CC1=CC=CC=C1)NC(=O)C2C(O2)C(=O)N3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C23H28N6O4/c1-27(2)21(31)17(15-16-7-4-3-5-8-16)26-20(30)18-19(33-18)22(32)28-11-13-29(14-12-28)23-24-9-6-10-25-23/h3-10,17-19H,11-15H2,1-2H3,(H,26,30)