3-[3-[4-isocyano-4-(2-methylphenyl)piperidin-1-yl]propyl]-5-(4-methylphenyl)-5-pyridin-2-yl-imidazolidine-2,4-dione

Systemtic Name: 3-[3-[4-isocyano-4-(2-methylphenyl)piperidin-1-yl]propyl]-5-(4-methylphenyl)-5-pyridin-2-yl-imidazolidine-2,4-dione Openeye Name: 3-[3-[4-isocyano-4-(o-tolyl)-1-piperidyl]propyl]-5-(p-tolyl)-5-(2-pyridyl)imidazolidine-2,4-dione CAS Name: 3-[3-[4-isocyano-4-(2-methylphenyl)-1-piperidinyl]propyl]-5-(4-methylphenyl)-5-(2-pyridinyl)imidazolidine-2,4-dione IUPAC Name: 3-[3-[4-isocyano-4-(2-methylphenyl)piperidin-1-yl]propyl]-5-(4-methylphenyl)-5-pyridin-2-ylimidazolidine-2,4-dione Traditional Name: 3-[3-[4-isocyano-4-(o-tolyl)piperidino]propyl]-5-(p-tolyl)-5-(2-pyridyl)hydantoin Formula: C31H33N5O2 MolecularWeight: 507.62602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(C(=O)N(C(=O)N2)CCCN3CCC(CC3)(C4=CC=CC=C4C)[N+]#[C-])C5=CC=CC=N5

Isomeric SMILES

CC1=CC=C(C=C1)C2(C(=O)N(C(=O)N2)CCCN3CCC(CC3)(C4=CC=CC=C4C)[N+]#[C-])C5=CC=CC=N5

InChI

InChI=1S/C31H33N5O2/c1-23-12-14-25(15-13-23)31(27-11-6-7-18-33-27)28(37)36(29(38)34-31)20-8-19-35-21-16-30(32-3,17-22-35)26-10-5-4-9-24(26)2/h4-7,9-15,18H,8,16-17,19-22H2,1-2H3,(H,34,38)