N-tert-butyl-4-[2-(4-chlorophenyl)-6-methyl-5-(phenylmethyl)pyrimidin-4-yl]piperazine-1-carboxamide

Systemtic Name: N-tert-butyl-4-[2-(4-chlorophenyl)-6-methyl-5-(phenylmethyl)pyrimidin-4-yl]piperazine-1-carboxamide Openeye Name: 4-[5-benzyl-2-(4-chlorophenyl)-6-methyl-pyrimidin-4-yl]-N-tert-butyl-piperazine-1-carboxamide CAS Name: N-tert-butyl-4-[2-(4-chlorophenyl)-6-methyl-5-(phenylmethyl)-4-pyrimidinyl]-1-piperazinecarboxamide IUPAC Name: 4-[5-benzyl-2-(4-chlorophenyl)-6-methylpyrimidin-4-yl]-N-tert-butylpiperazine-1-carboxamide Traditional Name: 4-[5-benzyl-2-(4-chlorophenyl)-6-methyl-pyrimidin-4-yl]-N-tert-butyl-piperazine-1-carboxamide Formula: C27H32ClN5O MolecularWeight: 478.02888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=C(C=C2)Cl)N3CCN(CC3)C(=O)NC(C)(C)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=C(C=C2)Cl)N3CCN(CC3)C(=O)NC(C)(C)C)CC4=CC=CC=C4

InChI

InChI=1S/C27H32ClN5O/c1-19-23(18-20-8-6-5-7-9-20)25(30-24(29-19)21-10-12-22(28)13-11-21)32-14-16-33(17-15-32)26(34)31-27(2,3)4/h5-13H,14-18H2,1-4H3,(H,31,34)