diethyl 2-[[4-chloranyl-6-(2-methylpropylamino)-1,3,5-triazin-2-yl]-cyano-amino]propanedioate

Systemtic Name: diethyl 2-[[4-chloranyl-6-(2-methylpropylamino)-1,3,5-triazin-2-yl]-cyano-amino]propanedioate Openeye Name: diethyl 2-[[4-chloro-6-(isobutylamino)-1,3,5-triazin-2-yl]-cyano-amino]propanedioate CAS Name: 2-[[4-chloro-6-(2-methylpropylamino)-1,3,5-triazin-2-yl]-cyanoamino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[4-chloro-6-(2-methylpropylamino)-1,3,5-triazin-2-yl]-cyanoamino]propanedioate Traditional Name: 2-[[4-chloro-6-(isobutylamino)-s-triazin-2-yl]-cyano-amino]malonic acid diethyl ester Formula: C15H21ClN6O4 MolecularWeight: 384.81804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)N(C#N)C1=NC(=NC(=N1)NCC(C)C)Cl

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)N(C#N)C1=NC(=NC(=N1)NCC(C)C)Cl

InChI

InChI=1S/C15H21ClN6O4/c1-5-25-11(23)10(12(24)26-6-2)22(8-17)15-20-13(16)19-14(21-15)18-7-9(3)4/h9-10H,5-7H2,1-4H3,(H,18,19,20,21)