4-[5-[(2,5-dimethylphenyl)methyl]-6-(methoxymethyl)-2-phenyl-pyrimidin-4-yl]-N-propan-2-yl-piperazine-1-carboxamide

Systemtic Name: 4-[5-[(2,5-dimethylphenyl)methyl]-6-(methoxymethyl)-2-phenyl-pyrimidin-4-yl]-N-propan-2-yl-piperazine-1-carboxamide Openeye Name: 4-[5-[(2,5-dimethylphenyl)methyl]-6-(methoxymethyl)-2-phenyl-pyrimidin-4-yl]-N-isopropyl-piperazine-1-carboxamide CAS Name: 4-[5-[(2,5-dimethylphenyl)methyl]-6-(methoxymethyl)-2-phenyl-4-pyrimidinyl]-N-propan-2-yl-1-piperazinecarboxamide IUPAC Name: 4-[5-[(2,5-dimethylphenyl)methyl]-6-(methoxymethyl)-2-phenylpyrimidin-4-yl]-N-propan-2-ylpiperazine-1-carboxamide Traditional Name: 4-[5-(2,5-dimethylbenzyl)-6-(methoxymethyl)-2-phenyl-pyrimidin-4-yl]-N-isopropyl-piperazine-1-carboxamide Formula: C29H37N5O2 MolecularWeight: 487.63638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CC2=C(N=C(N=C2N3CCN(CC3)C(=O)NC(C)C)C4=CC=CC=C4)COC

Isomeric SMILES

CC1=CC(=C(C=C1)C)CC2=C(N=C(N=C2N3CCN(CC3)C(=O)NC(C)C)C4=CC=CC=C4)COC

InChI

InChI=1S/C29H37N5O2/c1-20(2)30-29(35)34-15-13-33(14-16-34)28-25(18-24-17-21(3)11-12-22(24)4)26(19-36-5)31-27(32-28)23-9-7-6-8-10-23/h6-12,17,20H,13-16,18-19H2,1-5H3,(H,30,35)