3-ethyl-1-isocyanato-4-(2-methylimidazol-1-yl)-2,4-dihydro-1,3,5-triazine-2,6-diamine

Systemtic Name: 3-ethyl-1-isocyanato-4-(2-methylimidazol-1-yl)-2,4-dihydro-1,3,5-triazine-2,6-diamine Openeye Name: 3-ethyl-1-isocyanato-4-(2-methylimidazol-1-yl)-2,4-dihydro-1,3,5-triazine-2,6-diamine CAS Name: 3-ethyl-1-isocyanato-4-(2-methyl-1-imidazolyl)-2,4-dihydro-1,3,5-triazine-2,6-diamine IUPAC Name: 3-ethyl-1-isocyanato-4-(2-methylimidazol-1-yl)-2,4-dihydro-1,3,5-triazine-2,6-diamine Traditional Name: [2-amino-3-ethyl-1-isocyanato-4-(2-methylimidazol-1-yl)-2,4-dihydro-s-triazin-6-yl]amine Formula: C10H16N8O MolecularWeight: 264.28704

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(N(C(=NC1N2C=CN=C2C)N)N=C=O)N

Isomeric SMILES

CCN1C(N(C(=NC1N2C=CN=C2C)N)N=C=O)N

InChI

InChI=1S/C10H16N8O/c1-3-16-9(12)18(14-6-19)8(11)15-10(16)17-5-4-13-7(17)2/h4-5,9-10H,3,12H2,1-2H3,(H2,11,15)