4-(5-isocyano-3,6-dimethyl-pyridin-2-yl)-1,2-di(propan-2-yl)-1,2,4-triazolidine-3,5-dione

Systemtic Name: 4-(5-isocyano-3,6-dimethyl-pyridin-2-yl)-1,2-di(propan-2-yl)-1,2,4-triazolidine-3,5-dione Openeye Name: 4-(5-isocyano-3,6-dimethyl-2-pyridyl)-1,2-diisopropyl-1,2,4-triazolidine-3,5-dione CAS Name: 4-(5-isocyano-3,6-dimethyl-2-pyridinyl)-1,2-di(propan-2-yl)-1,2,4-triazolidine-3,5-dione IUPAC Name: 4-(5-isocyano-3,6-dimethylpyridin-2-yl)-1,2-di(propan-2-yl)-1,2,4-triazolidine-3,5-dione Traditional Name: 4-(5-isocyano-3,6-dimethyl-2-pyridyl)-1,2-diisopropyl-urazole Formula: C16H21N5O2 MolecularWeight: 315.37024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N=C1N2C(=O)N(N(C2=O)C(C)C)C(C)C)C)[N+]#[C-]

Isomeric SMILES

CC1=CC(=C(N=C1N2C(=O)N(N(C2=O)C(C)C)C(C)C)C)[N+]#[C-]

InChI

InChI=1S/C16H21N5O2/c1-9(2)20-15(22)19(16(23)21(20)10(3)4)14-11(5)8-13(17-7)12(6)18-14/h8-10H,1-6H3