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

Systemtic Name: 3-[3-[4-isocyano-4-(2-methylphenyl)piperidin-1-yl]propyl]-5-(4-methylphenyl)-5-pentyl-imidazolidine-2,4-dione Openeye Name: 3-[3-[4-isocyano-4-(o-tolyl)-1-piperidyl]propyl]-5-pentyl-5-(p-tolyl)imidazolidine-2,4-dione CAS Name: 3-[3-[4-isocyano-4-(2-methylphenyl)-1-piperidinyl]propyl]-5-(4-methylphenyl)-5-pentylimidazolidine-2,4-dione IUPAC Name: 3-[3-[4-isocyano-4-(2-methylphenyl)piperidin-1-yl]propyl]-5-(4-methylphenyl)-5-pentylimidazolidine-2,4-dione Traditional Name: 5-amyl-3-[3-[4-isocyano-4-(o-tolyl)piperidino]propyl]-5-(p-tolyl)hydantoin Formula: C31H40N4O2 MolecularWeight: 500.6749

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(C(=O)N(C(=O)N1)CCCN2CCC(CC2)(C3=CC=CC=C3C)[N+]#[C-])C4=CC=C(C=C4)C

Isomeric SMILES

CCCCCC1(C(=O)N(C(=O)N1)CCCN2CCC(CC2)(C3=CC=CC=C3C)[N+]#[C-])C4=CC=C(C=C4)C

InChI

InChI=1S/C31H40N4O2/c1-5-6-9-17-31(26-15-13-24(2)14-16-26)28(36)35(29(37)33-31)21-10-20-34-22-18-30(32-4,19-23-34)27-12-8-7-11-25(27)3/h7-8,11-16H,5-6,9-10,17-23H2,1-3H3,(H,33,37)