N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-1-(phenylcarbonyl)piperidine-4-carboxamide

Systemtic Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-1-(phenylcarbonyl)piperidine-4-carboxamide Openeye Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-1-benzoyl-piperidine-4-carboxamide CAS Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-4-pyrimidinyl]amino]ethyl]-1-benzoyl-4-piperidinecarboxamide IUPAC Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenylpyrimidin-4-yl]amino]ethyl]-1-benzoylpiperidine-4-carboxamide Traditional Name: N-[2-[[6-(2-acetamidoethylamino)-5-methyl-2-phenyl-pyrimidin-4-yl]amino]ethyl]-1-benzoyl-isonipecotamide Formula: C30H37N7O3 MolecularWeight: 543.65988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1NCCNC(=O)C)C2=CC=CC=C2)NCCNC(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(N=C1NCCNC(=O)C)C2=CC=CC=C2)NCCNC(=O)C3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C30H37N7O3/c1-21-26(32-16-15-31-22(2)38)35-28(23-9-5-3-6-10-23)36-27(21)33-17-18-34-29(39)24-13-19-37(20-14-24)30(40)25-11-7-4-8-12-25/h3-12,24H,13-20H2,1-2H3,(H,31,38)(H,34,39)(H2,32,33,35,36)